row_index,smiles,precursor_mz,adduct,collision_energy,fold,canonical_isomeric_smiles
446667,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br,316.97993,[M+H]+,20.0,val,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br
446668,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br,316.97993,[M+H]+,20.0,val,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br
446669,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br,316.97993,[M+H]+,60.0,val,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br
446670,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br,316.97993,[M+H]+,15.0,val,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br
446671,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br,316.97993,[M+H]+,20.0,val,Cc1nn(C(=O)c2nn(C)cc2Cl)c(C)c1Br
446672,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446673,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446674,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,60.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446675,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446676,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,45.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446677,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,60.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446678,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446679,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,233.05026,[M-H]-,45.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446680,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,217.05425,[M+H-H2O]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446681,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,217.05425,[M+H-H2O]+,60.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446682,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,217.05425,[M+H-H2O]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446683,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,217.05425,[M+H-H2O]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446684,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446685,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446686,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,60.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446687,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,30.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446688,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446689,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,60.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446690,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,30.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446691,CSc1nc(=O)c(-c2ccccc2N)n[nH]1,235.06481,[M+H]+,20.0,val,CSc1nc(=O)c(-c2ccccc2N)n[nH]1
446692,O=C(c1ncc(Br)cc1)N1CC(CO)C1,271.00767,[M+H]+,20.0,val,O=C(c1ccc(Br)cn1)N1CC(CO)C1
446693,O=C(c1ncc(Br)cc1)N1CC(CO)C1,271.00767,[M+H]+,20.0,val,O=C(c1ccc(Br)cn1)N1CC(CO)C1
446694,O=C(c1ncc(Br)cc1)N1CC(CO)C1,271.00767,[M+H]+,60.0,val,O=C(c1ccc(Br)cn1)N1CC(CO)C1
446695,O=C(c1ncc(Br)cc1)N1CC(CO)C1,271.00767,[M+H]+,30.0,val,O=C(c1ccc(Br)cn1)N1CC(CO)C1
446696,O=C(c1ncc(Br)cc1)N1CC(CO)C1,271.00767,[M+H]+,20.0,val,O=C(c1ccc(Br)cn1)N1CC(CO)C1
446697,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,20.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446698,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,20.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446699,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,60.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446700,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,30.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446701,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,20.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446702,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,60.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446703,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,30.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446704,FC(F)(F)c1c(Cl)nc(N2CCNCC2)cc1,266.06664,[M+H]+,20.0,val,FC(F)(F)c1ccc(N2CCNCC2)nc1Cl
446705,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446706,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446707,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446708,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,15.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446709,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446710,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446711,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446712,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446713,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,30.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446714,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446715,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,302.04617,[M-H]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446716,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,302.04617,[M-H]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446717,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,302.04617,[M-H]-,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446718,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,302.04617,[M-H]-,30.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446719,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,302.04617,[M-H]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446720,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,338.02285,[M+Cl]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446721,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446722,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446723,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446724,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,15.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446725,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446726,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446727,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,15.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446728,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,348.05165,[M+FA]-,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446729,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446730,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446731,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446732,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,30.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446733,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446734,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,60.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446735,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,30.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446736,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2nc(Cl)n1,304.06072,[M+H]+,20.0,val,Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
446737,O=C(O)C(CO)NS(=O)(=O)c1cc2c(cc1)[nH]c(=O)[nH]2,300.02958,[M-H]-,20.0,val,O=C(O)C(CO)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
446738,O=C(O)C(CO)NS(=O)(=O)c1cc2c(cc1)[nH]c(=O)[nH]2,300.02958,[M-H]-,20.0,val,O=C(O)C(CO)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
446739,O=C(O)C(CO)NS(=O)(=O)c1cc2c(cc1)[nH]c(=O)[nH]2,300.02958,[M-H]-,60.0,val,O=C(O)C(CO)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
446740,O=C(O)C(CO)NS(=O)(=O)c1cc2c(cc1)[nH]c(=O)[nH]2,300.02958,[M-H]-,30.0,val,O=C(O)C(CO)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
446741,O=C(O)C(CO)NS(=O)(=O)c1cc2c(cc1)[nH]c(=O)[nH]2,300.02958,[M-H]-,20.0,val,O=C(O)C(CO)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
446742,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446743,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446744,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446745,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446746,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446747,O=C(O)c1c(C2CC2)nc(C2CC2)s1,192.04777,[M+H-H2O]+,15.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446748,O=C(O)c1c(C2CC2)nc(C2CC2)s1,192.04777,[M+H-H2O]+,15.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446749,O=C(O)c1c(C2CC2)nc(C2CC2)s1,192.04777,[M+H-H2O]+,60.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446750,O=C(O)c1c(C2CC2)nc(C2CC2)s1,192.04777,[M+H-H2O]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446751,O=C(O)c1c(C2CC2)nc(C2CC2)s1,192.04777,[M+H-H2O]+,15.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446752,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446753,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446754,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446755,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446756,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446757,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446758,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446759,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446760,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446761,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446762,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446763,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446764,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446765,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446766,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446767,O=C(O)c1c(C2CC2)nc(C2CC2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1sc(C2CC2)nc1C1CC1
446768,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446769,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446770,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,60.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446771,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,30.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446772,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446773,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,60.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446774,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,30.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446775,O=C(O)C1C2CCC1(c1cscn1)C2,192.04777,[M+H-H2O]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446776,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446777,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446778,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,60.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446779,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,30.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446780,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446781,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,60.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446782,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,30.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446783,O=C(O)C1C2CCC1(c1cscn1)C2,210.05833,[M+H]+,20.0,val,O=C(O)C1C2CCC1(c1cscn1)C2
446784,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446785,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446786,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,60.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446787,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,30.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446788,O=C(O)c1cc2c(CN(C3CC3)C2)s1,210.05833,[M+H]+,20.0,val,O=C(O)c1cc2c(s1)CN(C1CC1)C2
446789,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1,314.00695,[M+H]+,20.0,val,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1
446790,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1,314.00695,[M+H]+,20.0,val,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1
446791,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1,314.00695,[M+H]+,60.0,val,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1
446792,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1,314.00695,[M+H]+,15.0,val,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1
446793,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1,314.00695,[M+H]+,20.0,val,Cc1nnc(N2CC(Cn3cc(Br)cn3)C2)s1
446794,O=C(CCCl)NCc1ccccc1,198.06802,[M+H]+,20.0,val,O=C(CCCl)NCc1ccccc1
446795,O=C(CCCl)NCc1ccccc1,198.06802,[M+H]+,20.0,val,O=C(CCCl)NCc1ccccc1
446796,O=C(CCCl)NCc1ccccc1,198.06802,[M+H]+,30.0,val,O=C(CCCl)NCc1ccccc1
446797,O=C(CCCl)NCc1ccccc1,198.06802,[M+H]+,60.0,val,O=C(CCCl)NCc1ccccc1
446798,O=C(CCCl)NCc1ccccc1,198.06802,[M+H]+,20.0,val,O=C(CCCl)NCc1ccccc1
446799,COC(=O)c1c[nH]c2c(CNCC2)c1=O,209.09207,[M+H]+,20.0,val,COC(=O)c1c[nH]c2c(c1=O)CNCC2
446800,COC(=O)c1c[nH]c2c(CNCC2)c1=O,209.09207,[M+H]+,20.0,val,COC(=O)c1c[nH]c2c(c1=O)CNCC2
446801,COC(=O)c1c[nH]c2c(CNCC2)c1=O,209.09207,[M+H]+,60.0,val,COC(=O)c1c[nH]c2c(c1=O)CNCC2
446802,COC(=O)c1c[nH]c2c(CNCC2)c1=O,209.09207,[M+H]+,30.0,val,COC(=O)c1c[nH]c2c(c1=O)CNCC2
446803,COC(=O)c1c[nH]c2c(CNCC2)c1=O,209.09207,[M+H]+,20.0,val,COC(=O)c1c[nH]c2c(c1=O)CNCC2
446804,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,207.07752,[M-H]-,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446805,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,207.07752,[M-H]-,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446806,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,207.07752,[M-H]-,60.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446807,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,207.07752,[M-H]-,15.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446808,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,207.07752,[M-H]-,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446809,Cc1cc(NC(=O)NCC(=O)O)ccc1,207.07752,[M-H]-,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446810,Cc1cc(NC(=O)NCC(=O)O)ccc1,207.07752,[M-H]-,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446811,Cc1cc(NC(=O)NCC(=O)O)ccc1,207.07752,[M-H]-,60.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446812,Cc1cc(NC(=O)NCC(=O)O)ccc1,207.07752,[M-H]-,15.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446813,Cc1cc(NC(=O)NCC(=O)O)ccc1,207.07752,[M-H]-,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446814,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446815,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446816,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,60.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446817,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,30.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446818,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446819,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,60.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446820,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,30.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446821,CN(C)C(=O)Nc1cccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446822,CC(C)C(=O)Nc1nccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446823,CC(C)C(=O)Nc1nccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446824,CC(C)C(=O)Nc1nccc(C(=O)O)c1,207.07752,[M-H]-,60.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446825,CC(C)C(=O)Nc1nccc(C(=O)O)c1,207.07752,[M-H]-,15.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446826,CC(C)C(=O)Nc1nccc(C(=O)O)c1,207.07752,[M-H]-,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446827,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446828,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446829,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,60.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446830,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,30.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446831,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446832,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,60.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446833,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,30.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446834,CC(C)C(=O)Nc1nccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CC(C)C(=O)Nc1cc(C(=O)O)ccn1
446835,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,20.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446836,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,20.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446837,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,60.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446838,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,15.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446839,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,20.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446840,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,60.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446841,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,15.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446842,O=C(O)c1nnc(OC2CCCC2)cc1,209.09207,[M+H]+,20.0,val,O=C(O)c1ccc(OC2CCCC2)nn1
446843,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446844,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446845,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,60.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446846,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,30.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446847,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446848,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,60.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446849,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,30.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446850,CN(C)C(=O)Nc1cccc(C(=O)O)c1,209.09207,[M+H]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446851,CN(C)C(=O)Nc1cccc(C(=O)O)c1,231.07401,[M+Na]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446852,CN(C)C(=O)Nc1cccc(C(=O)O)c1,231.07401,[M+Na]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446853,CN(C)C(=O)Nc1cccc(C(=O)O)c1,231.07401,[M+Na]+,60.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446854,CN(C)C(=O)Nc1cccc(C(=O)O)c1,231.07401,[M+Na]+,30.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446855,CN(C)C(=O)Nc1cccc(C(=O)O)c1,231.07401,[M+Na]+,20.0,val,CN(C)C(=O)Nc1cccc(C(=O)O)c1
446856,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446857,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446858,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,60.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446859,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,30.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446860,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446861,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,60.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446862,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,30.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446863,Cc1c(C(=O)O)ccc(C(=O)N(C)C)n1,209.09207,[M+H]+,20.0,val,Cc1nc(C(=O)N(C)C)ccc1C(=O)O
446864,Cc1cc(NC(=O)NCC(=O)O)ccc1,209.09207,[M+H]+,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446865,Cc1cc(NC(=O)NCC(=O)O)ccc1,209.09207,[M+H]+,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446866,Cc1cc(NC(=O)NCC(=O)O)ccc1,209.09207,[M+H]+,60.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446867,Cc1cc(NC(=O)NCC(=O)O)ccc1,209.09207,[M+H]+,15.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446868,Cc1cc(NC(=O)NCC(=O)O)ccc1,209.09207,[M+H]+,20.0,val,Cc1cccc(NC(=O)NCC(=O)O)c1
446869,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,20.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446870,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,20.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446871,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,60.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446872,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,30.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446873,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,20.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446874,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,60.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446875,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,30.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446876,O=C(O)Cn1ncc2c(CCCC2)c1=O,209.09207,[M+H]+,20.0,val,O=C(O)Cn1ncc2c(c1=O)CCCC2
446877,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@H](N)C(=O)O
446878,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@H](N)C(=O)O
446879,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,209.09207,[M+H]+,60.0,val,Nc1ccccc1C(=O)C[C@H](N)C(=O)O
446880,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,209.09207,[M+H]+,15.0,val,Nc1ccccc1C(=O)C[C@H](N)C(=O)O
446881,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@H](N)C(=O)O
446882,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O
446883,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O
446884,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O,209.09207,[M+H]+,15.0,val,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O
446885,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O,209.09207,[M+H]+,60.0,val,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O
446886,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)C[C@@H](N)C(=O)O
446887,CC(NC(=O)c1ccccc1N)C(=O)O,207.07752,[M-H]-,20.0,val,CC(NC(=O)c1ccccc1N)C(=O)O
446888,CC(NC(=O)c1ccccc1N)C(=O)O,207.07752,[M-H]-,20.0,val,CC(NC(=O)c1ccccc1N)C(=O)O
446889,CC(NC(=O)c1ccccc1N)C(=O)O,207.07752,[M-H]-,60.0,val,CC(NC(=O)c1ccccc1N)C(=O)O
446890,CC(NC(=O)c1ccccc1N)C(=O)O,207.07752,[M-H]-,15.0,val,CC(NC(=O)c1ccccc1N)C(=O)O
446891,CC(NC(=O)c1ccccc1N)C(=O)O,207.07752,[M-H]-,20.0,val,CC(NC(=O)c1ccccc1N)C(=O)O
446892,Nc1ccccc1C(=O)CC(N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)CC(N)C(=O)O
446893,Nc1ccccc1C(=O)CC(N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)CC(N)C(=O)O
446894,Nc1ccccc1C(=O)CC(N)C(=O)O,209.09207,[M+H]+,60.0,val,Nc1ccccc1C(=O)CC(N)C(=O)O
446895,Nc1ccccc1C(=O)CC(N)C(=O)O,209.09207,[M+H]+,15.0,val,Nc1ccccc1C(=O)CC(N)C(=O)O
446896,Nc1ccccc1C(=O)CC(N)C(=O)O,209.09207,[M+H]+,20.0,val,Nc1ccccc1C(=O)CC(N)C(=O)O
446897,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,251.07858,[M-H]-,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446898,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,251.07858,[M-H]-,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446899,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,251.07858,[M-H]-,60.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446900,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,251.07858,[M-H]-,30.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446901,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,251.07858,[M-H]-,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446902,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,297.08406,[M+FA]-,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446903,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,297.08406,[M+FA]-,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446904,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,297.08406,[M+FA]-,60.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446905,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,297.08406,[M+FA]-,15.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446906,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,297.08406,[M+FA]-,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446907,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,253.09313,[M+H]+,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446908,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,253.09313,[M+H]+,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446909,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,253.09313,[M+H]+,60.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446910,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,253.09313,[M+H]+,15.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446911,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O,253.09313,[M+H]+,20.0,val,N#C[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O
446912,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,253.09313,[M+H]+,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446913,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,253.09313,[M+H]+,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446914,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,253.09313,[M+H]+,15.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446915,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,253.09313,[M+H]+,60.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446916,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1,253.09313,[M+H]+,20.0,val,O=c1nc[nH]c2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
446917,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,297.08406,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446918,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,297.08406,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446919,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,297.08406,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446920,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,297.08406,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446921,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,297.08406,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446922,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,253.09313,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446923,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,253.09313,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446924,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,253.09313,[M+H]+,60.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446925,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,253.09313,[M+H]+,15.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446926,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O,253.09313,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O
446927,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446928,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446929,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,60.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446930,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,30.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446931,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446932,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,60.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446933,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,30.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446934,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446935,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446936,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446937,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,60.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446938,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,15.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446939,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446940,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446941,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446942,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,60.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446943,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,15.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446944,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446945,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,60.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446946,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,15.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446947,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,299.04556,[M-H]-,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446948,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446949,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446950,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,60.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446951,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,30.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446952,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446953,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,60.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446954,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,30.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446955,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,299.04556,[M-H]-,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446956,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446957,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446958,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,60.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446959,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,30.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446960,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446961,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,60.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446962,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,30.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446963,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O,301.06012,[M+H]+,20.0,val,C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O
446964,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,301.06012,[M+H]+,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446965,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,301.06012,[M+H]+,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446966,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,301.06012,[M+H]+,60.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446967,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,301.06012,[M+H]+,15.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446968,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O,301.06012,[M+H]+,20.0,val,CN1c2cc(O)c(N=NC(N)=O)cc2CC1S(=O)(=O)O
446969,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,334.97066,[M-H]-,20.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446970,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,334.97066,[M-H]-,60.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446971,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,334.97066,[M-H]-,15.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446972,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,334.97066,[M-H]-,20.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446973,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,336.98522,[M+H]+,15.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446974,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,336.98522,[M+H]+,15.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446975,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,336.98522,[M+H]+,20.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446976,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,336.98522,[M+H]+,60.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446977,COC(=O)c1c(Br)sc(NC(=O)OC(C)(C)C)n1,336.98522,[M+H]+,15.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446978,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br,336.98522,[M+H]+,30.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446979,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br,336.98522,[M+H]+,30.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446980,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br,336.98522,[M+H]+,60.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446981,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br,336.98522,[M+H]+,20.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446982,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br,336.98522,[M+H]+,30.0,val,COC(=O)c1nc(NC(=O)OC(C)(C)C)sc1Br
446983,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446984,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446985,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446986,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,30.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446987,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446988,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446989,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446990,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,45.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446991,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446992,C/C(=C\CNc1ncnc2nc[nH]c12)CO,218.10473,[M-H]-,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446993,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446994,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446995,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,45.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446996,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446997,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446998,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
446999,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447000,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447001,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,30.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447002,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447003,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,30.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447004,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447005,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447006,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,45.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447007,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,45.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447008,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,45.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447009,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447010,C/C(=C\CNc1ncnc2nc[nH]c12)CO,202.10873,[M+H-H2O]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447011,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447012,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447013,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447014,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,30.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447015,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447016,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,30.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447017,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,20.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447018,C/C(=C\CNc1ncnc2nc[nH]c12)CO,220.11929,[M+H]+,60.0,val,C/C(=C\CNc1ncnc2nc[nH]c12)CO
447019,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447020,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447021,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,60.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447022,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,30.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447023,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447024,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,60.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447025,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,30.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447026,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,266.07172,[M-H]-,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447027,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,268.08627,[M+H]+,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447028,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,268.08627,[M+H]+,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447029,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,268.08627,[M+H]+,60.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447030,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,268.08627,[M+H]+,15.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447031,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O,268.08627,[M+H]+,20.0,val,O=C(Nc1nc(C2CC2)ns1)NC1CCNC1=O
447032,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447033,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447034,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,60.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447035,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,30.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447036,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447037,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,60.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447038,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,30.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447039,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,337.95257,[M-H]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447040,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,373.92925,[M+Cl]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447041,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,373.92925,[M+Cl]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447042,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,373.92925,[M+Cl]-,60.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447043,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,373.92925,[M+Cl]-,15.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447044,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1,373.92925,[M+Cl]-,20.0,val,O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1
447045,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447046,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447047,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,60.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447048,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447049,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,45.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447050,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,60.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447051,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447052,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,328.05844,[M-H]-,45.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447053,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,330.07299,[M+H]+,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447054,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,330.07299,[M+H]+,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447055,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,330.07299,[M+H]+,60.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447056,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,330.07299,[M+H]+,20.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447057,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1,330.07299,[M+H]+,45.0,val,COCCS(=O)(=O)NC(=O)C(C)n1ccc(C(F)(F)F)n1
447058,Cn1ncc(I)c1C(=O)NC1CCCC1,320.02544,[M+H]+,20.0,val,Cn1ncc(I)c1C(=O)NC1CCCC1
447059,Cn1ncc(I)c1C(=O)NC1CCCC1,320.02544,[M+H]+,20.0,val,Cn1ncc(I)c1C(=O)NC1CCCC1
447060,Cn1ncc(I)c1C(=O)NC1CCCC1,320.02544,[M+H]+,45.0,val,Cn1ncc(I)c1C(=O)NC1CCCC1
447061,Cn1ncc(I)c1C(=O)NC1CCCC1,320.02544,[M+H]+,60.0,val,Cn1ncc(I)c1C(=O)NC1CCCC1
447062,Cn1ncc(I)c1C(=O)NC1CCCC1,320.02544,[M+H]+,20.0,val,Cn1ncc(I)c1C(=O)NC1CCCC1
447063,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,241.06524,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447064,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,241.06524,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447065,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,241.06524,[M-H]-,60.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447066,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,241.06524,[M-H]-,15.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447067,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,241.06524,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447068,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,20.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447069,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,20.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447070,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,60.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447071,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,20.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447072,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,45.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447073,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,60.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447074,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,20.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447075,Cc1c(CC(=O)O)sc(N2CCOCC2)n1,243.07979,[M+H]+,45.0,val,Cc1nc(N2CCOCC2)sc1CC(=O)O
447076,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447077,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447078,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,60.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447079,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,30.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447080,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447081,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,60.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447082,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,30.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447083,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,243.07979,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447084,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,265.06173,[M+Na]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447085,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,265.06173,[M+Na]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447086,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,265.06173,[M+Na]+,60.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447087,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,265.06173,[M+Na]+,30.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447088,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1,265.06173,[M+Na]+,20.0,val,CC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1
447089,CN(C)CCc1ccc(O)cc1,166.12264,[M+H]+,30.0,val,CN(C)CCc1ccc(O)cc1
447090,CN(C)CCc1ccc(O)cc1,166.12264,[M+H]+,30.0,val,CN(C)CCc1ccc(O)cc1
447091,CN(C)CCc1ccc(O)cc1,166.12264,[M+H]+,20.0,val,CN(C)CCc1ccc(O)cc1
447092,CN(C)CCc1ccc(O)cc1,166.12264,[M+H]+,60.0,val,CN(C)CCc1ccc(O)cc1
447093,CN(C)CCc1ccc(O)cc1,166.12264,[M+H]+,30.0,val,CN(C)CCc1ccc(O)cc1
447094,CC(C)COc1ccccc1N,166.12264,[M+H]+,20.0,val,CC(C)COc1ccccc1N
447095,CC(C)COc1ccccc1N,166.12264,[M+H]+,20.0,val,CC(C)COc1ccccc1N
447096,CC(C)COc1ccccc1N,166.12264,[M+H]+,60.0,val,CC(C)COc1ccccc1N
447097,CC(C)COc1ccccc1N,166.12264,[M+H]+,15.0,val,CC(C)COc1ccccc1N
447098,CC(C)COc1ccccc1N,166.12264,[M+H]+,20.0,val,CC(C)COc1ccccc1N
447099,O=C1CC(C(=O)O)C2CCCCC2N1,196.09792,[M-H]-,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447100,O=C1CC(C(=O)O)C2CCCCC2N1,196.09792,[M-H]-,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447101,O=C1CC(C(=O)O)C2CCCCC2N1,196.09792,[M-H]-,45.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447102,O=C1CC(C(=O)O)C2CCCCC2N1,196.09792,[M-H]-,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447103,O=C1CC(C(=O)O)C2CCCCC2N1,196.09792,[M-H]-,45.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447104,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447105,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447106,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,60.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447107,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447108,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447109,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,60.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447110,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447111,O=C(O)C1CCCN(C(=O)C2CC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447112,O=C(O)C1CCN(C(=O)C2CC2)CC1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447113,O=C(O)C1CCN(C(=O)C2CC2)CC1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447114,O=C(O)C1CCN(C(=O)C2CC2)CC1,196.09792,[M-H]-,60.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447115,O=C(O)C1CCN(C(=O)C2CC2)CC1,196.09792,[M-H]-,30.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447116,O=C(O)C1CCN(C(=O)C2CC2)CC1,196.09792,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447117,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447118,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447119,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,60.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447120,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,30.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447121,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447122,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,60.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447123,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,30.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447124,O=C1CCCCC2(C(=O)O)CCCN12,196.09792,[M-H]-,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447125,O=C(O)C1CC(=O)N(C2CCCC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447126,O=C(O)C1CC(=O)N(C2CCCC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447127,O=C(O)C1CC(=O)N(C2CCCC2)C1,196.09792,[M-H]-,60.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447128,O=C(O)C1CC(=O)N(C2CCCC2)C1,196.09792,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447129,O=C(O)C1CC(=O)N(C2CCCC2)C1,196.09792,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447130,O=C(O)C1CCCN(C(=O)C2CC2)C1,180.10191,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447131,O=C(O)C1CCCN(C(=O)C2CC2)C1,180.10191,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447132,O=C(O)C1CCCN(C(=O)C2CC2)C1,180.10191,[M+H-H2O]+,60.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447133,O=C(O)C1CCCN(C(=O)C2CC2)C1,180.10191,[M+H-H2O]+,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447134,O=C(O)C1CCCN(C(=O)C2CC2)C1,180.10191,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447135,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447136,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447137,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447138,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447139,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447140,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447141,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447142,O=C(O)C1CCCN(C(=O)C2CC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447143,O=C(O)C1CCCN(C(=O)C2CC2)C1,220.09441,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447144,O=C(O)C1CCCN(C(=O)C2CC2)C1,220.09441,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447145,O=C(O)C1CCCN(C(=O)C2CC2)C1,220.09441,[M+Na]+,30.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447146,O=C(O)C1CCCN(C(=O)C2CC2)C1,220.09441,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)C2CC2)C1
447147,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447148,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447149,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,60.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447150,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447151,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,45.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447152,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,60.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447153,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447154,O=C(O)C1CC(=O)N(C2CCCC2)C1,162.09135,[M+H-2H2O]+,45.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447155,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447156,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447157,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447158,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447159,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447160,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,45.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447161,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447162,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447163,O=C(O)C1CC(=O)N(C2CCCC2)C1,198.11247,[M+H]+,45.0,val,O=C(O)C1CC(=O)N(C2CCCC2)C1
447164,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447165,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447166,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447167,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,30.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447168,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447169,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447170,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,30.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447171,O=C(O)C1CCN(C(=O)C2CC2)CC1,198.11247,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)C2CC2)CC1
447172,CC(C)(C)c1cnc(CCC(=O)O)o1,162.09135,[M+H-2H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447173,CC(C)(C)c1cnc(CCC(=O)O)o1,162.09135,[M+H-2H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447174,CC(C)(C)c1cnc(CCC(=O)O)o1,162.09135,[M+H-2H2O]+,60.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447175,CC(C)(C)c1cnc(CCC(=O)O)o1,162.09135,[M+H-2H2O]+,30.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447176,CC(C)(C)c1cnc(CCC(=O)O)o1,162.09135,[M+H-2H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447177,CC(C)(C)c1cnc(CCC(=O)O)o1,180.10191,[M+H-H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447178,CC(C)(C)c1cnc(CCC(=O)O)o1,180.10191,[M+H-H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447179,CC(C)(C)c1cnc(CCC(=O)O)o1,180.10191,[M+H-H2O]+,60.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447180,CC(C)(C)c1cnc(CCC(=O)O)o1,180.10191,[M+H-H2O]+,30.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447181,CC(C)(C)c1cnc(CCC(=O)O)o1,180.10191,[M+H-H2O]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447182,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447183,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447184,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,60.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447185,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,30.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447186,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447187,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,60.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447188,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,30.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447189,CC(C)(C)c1cnc(CCC(=O)O)o1,198.11247,[M+H]+,20.0,val,CC(C)(C)c1cnc(CCC(=O)O)o1
447190,O=C1CC(C(=O)O)C2CCCCC2N1,180.10191,[M+H-H2O]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447191,O=C1CC(C(=O)O)C2CCCCC2N1,180.10191,[M+H-H2O]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447192,O=C1CC(C(=O)O)C2CCCCC2N1,180.10191,[M+H-H2O]+,60.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447193,O=C1CC(C(=O)O)C2CCCCC2N1,180.10191,[M+H-H2O]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447194,O=C1CC(C(=O)O)C2CCCCC2N1,180.10191,[M+H-H2O]+,45.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447195,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447196,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447197,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,60.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447198,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,30.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447199,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447200,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,60.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447201,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,30.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447202,O=C1CC(C(=O)O)C2CCCCC2N1,198.11247,[M+H]+,20.0,val,O=C1CC(C(=O)O)C2CCCCC2N1
447203,Cc1c(CC(=O)O)oc(C(C)(C)C)n1,198.11247,[M+H]+,20.0,val,Cc1nc(C(C)(C)C)oc1CC(=O)O
447204,Cc1c(CC(=O)O)oc(C(C)(C)C)n1,198.11247,[M+H]+,20.0,val,Cc1nc(C(C)(C)C)oc1CC(=O)O
447205,Cc1c(CC(=O)O)oc(C(C)(C)C)n1,198.11247,[M+H]+,60.0,val,Cc1nc(C(C)(C)C)oc1CC(=O)O
447206,Cc1c(CC(=O)O)oc(C(C)(C)C)n1,198.11247,[M+H]+,20.0,val,Cc1nc(C(C)(C)C)oc1CC(=O)O
447207,Cc1c(CC(=O)O)oc(C(C)(C)C)n1,198.11247,[M+H]+,45.0,val,Cc1nc(C(C)(C)C)oc1CC(=O)O
447208,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447209,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447210,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,60.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447211,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447212,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,45.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447213,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,60.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447214,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,20.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447215,O=C1CCCCC2(C(=O)O)CCCN12,198.11247,[M+H]+,45.0,val,O=C1CCCCC2(C(=O)O)CCCN12
447216,CCC(C)C1NC(=O)C(C(C)=O)=C1O,196.09792,[M-H]-,20.0,val,CCC(C)C1NC(=O)C(C(C)=O)=C1O
447217,CCC(C)C1NC(=O)C(C(C)=O)=C1O,196.09792,[M-H]-,20.0,val,CCC(C)C1NC(=O)C(C(C)=O)=C1O
447218,CCC(C)C1NC(=O)C(C(C)=O)=C1O,196.09792,[M-H]-,60.0,val,CCC(C)C1NC(=O)C(C(C)=O)=C1O
447219,CCC(C)C1NC(=O)C(C(C)=O)=C1O,196.09792,[M-H]-,20.0,val,CCC(C)C1NC(=O)C(C(C)=O)=C1O
447220,CCC(C)C1NC(=O)C(C(C)=O)=C1O,196.09792,[M-H]-,45.0,val,CCC(C)C1NC(=O)C(C(C)=O)=C1O
447221,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2,252.13182,[M+H]+,30.0,val,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2
447222,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2,252.13182,[M+H]+,30.0,val,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2
447223,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2,252.13182,[M+H]+,20.0,val,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2
447224,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2,252.13182,[M+H]+,60.0,val,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2
447225,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2,252.13182,[M+H]+,30.0,val,N[C@]12CC[C@H]1CN(C(=O)NCCC(F)(F)F)C2
447226,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,323.0377,[M-H]-,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447227,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,323.0377,[M-H]-,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447228,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,323.0377,[M-H]-,60.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447229,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,323.0377,[M-H]-,15.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447230,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,323.0377,[M-H]-,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447231,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,325.05225,[M+H]+,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447232,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,325.05225,[M+H]+,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447233,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,325.05225,[M+H]+,60.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447234,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,325.05225,[M+H]+,30.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447235,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O,325.05225,[M+H]+,20.0,val,CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(=O)O)C(=O)O
447236,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,303.09462,[M-H]-,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447237,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,303.09462,[M-H]-,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447238,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,303.09462,[M-H]-,60.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447239,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,303.09462,[M-H]-,30.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447240,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,303.09462,[M-H]-,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447241,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447242,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447243,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,60.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447244,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,30.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447245,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447246,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,20.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447247,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,30.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447248,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1,305.10917,[M+H]+,60.0,val,Nc1nc(=O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(N)[nH]1
447249,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,311.08666,[M-H]-,15.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447250,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,311.08666,[M-H]-,15.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447251,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,311.08666,[M-H]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447252,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,311.08666,[M-H]-,60.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447253,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,311.08666,[M-H]-,15.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447254,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,347.06334,[M+Cl]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447255,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,347.06334,[M+Cl]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447256,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,347.06334,[M+Cl]-,60.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447257,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,347.06334,[M+Cl]-,15.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447258,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,347.06334,[M+Cl]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447259,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,357.09214,[M+FA]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447260,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,357.09214,[M+FA]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447261,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,357.09214,[M+FA]-,60.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447262,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,357.09214,[M+FA]-,15.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447263,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,357.09214,[M+FA]-,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447264,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,313.10121,[M+H]+,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447265,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,313.10121,[M+H]+,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447266,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,313.10121,[M+H]+,60.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447267,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,313.10121,[M+H]+,30.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447268,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1,313.10121,[M+H]+,20.0,val,CN=C(NC#N)NCCSCc1csc(N=C(N)N)n1
447269,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447270,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447271,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,60.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447272,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,30.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447273,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447274,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,45.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447275,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,60.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447276,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,274.0867,[M-H]-,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447277,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,276.10125,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447278,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,276.10125,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447279,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,276.10125,[M+H]+,60.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447280,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,276.10125,[M+H]+,30.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447281,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C,276.10125,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N(C)[C@@H](C)C(=O)O)nc1C
447282,O=C(O)C1CCC2CCCCC2N1,184.13321,[M+H]+,20.0,val,O=C(O)C1CCC2CCCCC2N1
447283,O=C(O)C1CCC2CCCCC2N1,184.13321,[M+H]+,20.0,val,O=C(O)C1CCC2CCCCC2N1
447284,O=C(O)C1CCC2CCCCC2N1,184.13321,[M+H]+,60.0,val,O=C(O)C1CCC2CCCCC2N1
447285,O=C(O)C1CCC2CCCCC2N1,184.13321,[M+H]+,20.0,val,O=C(O)C1CCC2CCCCC2N1
447286,O=C(O)C1CCC2CCCCC2N1,184.13321,[M+H]+,45.0,val,O=C(O)C1CCC2CCCCC2N1
447287,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,20.0,val,O=C(O)C1CN(C2CCCCC2)C1
447288,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,20.0,val,O=C(O)C1CN(C2CCCCC2)C1
447289,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,60.0,val,O=C(O)C1CN(C2CCCCC2)C1
447290,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,30.0,val,O=C(O)C1CN(C2CCCCC2)C1
447291,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,20.0,val,O=C(O)C1CN(C2CCCCC2)C1
447292,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,60.0,val,O=C(O)C1CN(C2CCCCC2)C1
447293,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,30.0,val,O=C(O)C1CN(C2CCCCC2)C1
447294,O=C(O)C1CN(C2CCCCC2)C1,184.13321,[M+H]+,20.0,val,O=C(O)C1CN(C2CCCCC2)C1
447295,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,324.0581,[M+FA]-,20.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447296,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,324.0581,[M+FA]-,60.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447297,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,324.0581,[M+FA]-,15.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447298,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,324.0581,[M+FA]-,20.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447299,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,280.06718,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447300,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,280.06718,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447301,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,280.06718,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447302,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,280.06718,[M+H]+,15.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447303,Cc1c(C)sc(S(=O)(=O)N(CCO)CCO)c1,280.06718,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)N(CCO)CCO)sc1C
447304,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,261.09145,[M-H]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447305,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,261.09145,[M-H]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447306,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,261.09145,[M-H]-,60.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447307,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,261.09145,[M-H]-,30.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447308,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,261.09145,[M-H]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447309,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,307.09693,[M+FA]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447310,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,307.09693,[M+FA]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447311,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,307.09693,[M+FA]-,60.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447312,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,307.09693,[M+FA]-,15.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447313,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,307.09693,[M+FA]-,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447314,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447315,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447316,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,60.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447317,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,30.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447318,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447319,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,60.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447320,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,30.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447321,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,261.09145,[M-H]-,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447322,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,245.09544,[M+H-H2O]+,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447323,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,245.09544,[M+H-H2O]+,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447324,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,245.09544,[M+H-H2O]+,60.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447325,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,245.09544,[M+H-H2O]+,15.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447326,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,245.09544,[M+H-H2O]+,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447327,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,263.106,[M+H]+,30.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447328,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,263.106,[M+H]+,30.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447329,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,263.106,[M+H]+,20.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447330,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,263.106,[M+H]+,60.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447331,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1,263.106,[M+H]+,30.0,val,O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)N2CCCC2)C1
447332,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,263.106,[M+H]+,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447333,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,263.106,[M+H]+,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447334,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,263.106,[M+H]+,60.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447335,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,263.106,[M+H]+,30.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447336,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1,263.106,[M+H]+,20.0,val,O=C(NC1CCCS(=O)(=O)C1)N1CCOCC1
447337,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447338,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447339,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,60.0,val,CC1CCC(C(C)C)C(N)C1
447340,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,15.0,val,CC1CCC(C(C)C)C(N)C1
447341,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447342,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447343,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447344,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,60.0,val,CC1CCC(C(C)C)C(N)C1
447345,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,15.0,val,CC1CCC(C(C)C)C(N)C1
447346,CC1CCC(C(C)C)C(N)C1,156.17468,[M+H]+,20.0,val,CC1CCC(C(C)C)C(N)C1
447347,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447348,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447349,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447350,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,30.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447351,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447352,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447353,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447354,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447355,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447356,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,45.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447357,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447358,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447359,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,45.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447360,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447361,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447362,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447363,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,30.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447364,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,266.12453,[M-H]-,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447365,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447366,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447367,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447368,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447369,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,45.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447370,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,60.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447371,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,20.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447372,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O,268.13908,[M+H]+,45.0,val,OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
447373,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447374,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447375,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,60.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447376,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,30.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447377,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447378,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447379,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447380,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,60.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447381,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,30.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447382,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447383,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,60.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447384,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,30.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447385,CC[C@@H](CO)NCCN[C@@H](CC)CO,205.19105,[M+H]+,20.0,val,CC[C@@H](CO)NCCN[C@@H](CC)CO
447386,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447387,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447388,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,222.98036,[M-H]-,60.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447389,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,222.98036,[M-H]-,15.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447390,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447391,O=C(O)c1cc(=O)c2c(ccc(Cl)c2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2cc(Cl)ccc2o1
447392,O=C(O)c1cc(=O)c2c(ccc(Cl)c2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2cc(Cl)ccc2o1
447393,O=C(O)c1cc(=O)c2c(ccc(Cl)c2)o1,222.98036,[M-H]-,60.0,val,O=C(O)c1cc(=O)c2cc(Cl)ccc2o1
447394,O=C(O)c1cc(=O)c2c(ccc(Cl)c2)o1,222.98036,[M-H]-,15.0,val,O=C(O)c1cc(=O)c2cc(Cl)ccc2o1
447395,O=C(O)c1cc(=O)c2c(ccc(Cl)c2)o1,222.98036,[M-H]-,20.0,val,O=C(O)c1cc(=O)c2cc(Cl)ccc2o1
447396,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,224.99491,[M+H]+,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447397,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,224.99491,[M+H]+,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447398,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,224.99491,[M+H]+,60.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447399,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,224.99491,[M+H]+,20.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447400,O=C(O)c1cc(=O)c2c(cc(Cl)cc2)o1,224.99491,[M+H]+,45.0,val,O=C(O)c1cc(=O)c2ccc(Cl)cc2o1
447401,O=C(O)c1c2cnccc2c(F)cc1,190.03098,[M-H]-,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447402,O=C(O)c1c2cnccc2c(F)cc1,190.03098,[M-H]-,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447403,O=C(O)c1c2cnccc2c(F)cc1,190.03098,[M-H]-,60.0,val,O=C(O)c1ccc(F)c2ccncc12
447404,O=C(O)c1c2cnccc2c(F)cc1,190.03098,[M-H]-,15.0,val,O=C(O)c1ccc(F)c2ccncc12
447405,O=C(O)c1c2cnccc2c(F)cc1,190.03098,[M-H]-,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447406,O=C(O)c1cnc2ccc(F)cc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447407,O=C(O)c1cnc2ccc(F)cc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447408,O=C(O)c1cnc2ccc(F)cc2c1,190.03098,[M-H]-,60.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447409,O=C(O)c1cnc2ccc(F)cc2c1,190.03098,[M-H]-,15.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447410,O=C(O)c1cnc2ccc(F)cc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447411,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447412,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447413,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,60.0,val,O=C(O)c1cnc2c(F)cccc2c1
447414,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,15.0,val,O=C(O)c1cnc2c(F)cccc2c1
447415,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447416,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,60.0,val,O=C(O)c1cnc2c(F)cccc2c1
447417,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,15.0,val,O=C(O)c1cnc2c(F)cccc2c1
447418,O=C(O)c1cnc2c(F)cccc2c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447419,O=C(O)c1c2cnccc2cc(F)c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447420,O=C(O)c1c2cnccc2cc(F)c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447421,O=C(O)c1c2cnccc2cc(F)c1,190.03098,[M-H]-,60.0,val,O=C(O)c1cc(F)cc2ccncc12
447422,O=C(O)c1c2cnccc2cc(F)c1,190.03098,[M-H]-,15.0,val,O=C(O)c1cc(F)cc2ccncc12
447423,O=C(O)c1c2cnccc2cc(F)c1,190.03098,[M-H]-,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447424,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447425,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447426,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cc(F)cc2ccncc12
447427,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447428,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cc(F)cc2ccncc12
447429,O=C(O)c1c2cnccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2ccncc12
447430,O=C(O)c1c2ncccc2cc(F)c1,174.03497,[M+H-H2O]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447431,O=C(O)c1c2ncccc2cc(F)c1,174.03497,[M+H-H2O]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447432,O=C(O)c1c2ncccc2cc(F)c1,174.03497,[M+H-H2O]+,60.0,val,O=C(O)c1cc(F)cc2cccnc12
447433,O=C(O)c1c2ncccc2cc(F)c1,174.03497,[M+H-H2O]+,30.0,val,O=C(O)c1cc(F)cc2cccnc12
447434,O=C(O)c1c2ncccc2cc(F)c1,174.03497,[M+H-H2O]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447435,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447436,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447437,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cc(F)cc2cccnc12
447438,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447439,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,45.0,val,O=C(O)c1cc(F)cc2cccnc12
447440,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cc(F)cc2cccnc12
447441,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cc(F)cc2cccnc12
447442,O=C(O)c1c2ncccc2cc(F)c1,192.04553,[M+H]+,45.0,val,O=C(O)c1cc(F)cc2cccnc12
447443,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447444,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447445,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cnc2c(F)cccc2c1
447446,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447447,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,45.0,val,O=C(O)c1cnc2c(F)cccc2c1
447448,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cnc2c(F)cccc2c1
447449,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2c(F)cccc2c1
447450,O=C(O)c1cnc2c(F)cccc2c1,192.04553,[M+H]+,45.0,val,O=C(O)c1cnc2c(F)cccc2c1
447451,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,20.0,val,O=C(O)c1c(F)ccc2ccncc12
447452,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,20.0,val,O=C(O)c1c(F)ccc2ccncc12
447453,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,60.0,val,O=C(O)c1c(F)ccc2ccncc12
447454,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,15.0,val,O=C(O)c1c(F)ccc2ccncc12
447455,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,20.0,val,O=C(O)c1c(F)ccc2ccncc12
447456,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,45.0,val,O=C(O)c1c(F)ccc2ccncc12
447457,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,60.0,val,O=C(O)c1c(F)ccc2ccncc12
447458,O=C(O)c1c2cnccc2ccc1F,192.04553,[M+H]+,20.0,val,O=C(O)c1c(F)ccc2ccncc12
447459,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447460,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447461,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,60.0,val,O=C(O)c1ccc(F)c2ccncc12
447462,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447463,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,60.0,val,O=C(O)c1ccc(F)c2ccncc12
447464,O=C(O)c1c2cnccc2c(F)cc1,192.04553,[M+H]+,20.0,val,O=C(O)c1ccc(F)c2ccncc12
447465,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447466,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447467,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447468,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447469,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,45.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447470,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,60.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447471,O=C(O)c1cnc2ccc(F)cc2c1,192.04553,[M+H]+,20.0,val,O=C(O)c1cnc2ccc(F)cc2c1
447472,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447473,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447474,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,60.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447475,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,15.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447476,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447477,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,60.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447478,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,15.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447479,O=C(O)c1cnc(-c2ccccc2F)s1,222.00305,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447480,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447481,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447482,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,60.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447483,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447484,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,45.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447485,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,60.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447486,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447487,O=C(O)c1cnc(-c2ccccc2F)s1,224.0176,[M+H]+,45.0,val,O=C(O)c1cnc(-c2ccccc2F)s1
447488,O=c1[nH]nc(SCc2c(Cl)ccc(Cl)c2)c(=O)[nH]1,301.95633,[M-H]-,20.0,val,O=c1[nH]nc(SCc2cc(Cl)ccc2Cl)c(=O)[nH]1
447489,O=c1[nH]nc(SCc2c(Cl)ccc(Cl)c2)c(=O)[nH]1,301.95633,[M-H]-,20.0,val,O=c1[nH]nc(SCc2cc(Cl)ccc2Cl)c(=O)[nH]1
447490,O=c1[nH]nc(SCc2c(Cl)ccc(Cl)c2)c(=O)[nH]1,301.95633,[M-H]-,60.0,val,O=c1[nH]nc(SCc2cc(Cl)ccc2Cl)c(=O)[nH]1
447491,O=c1[nH]nc(SCc2c(Cl)ccc(Cl)c2)c(=O)[nH]1,301.95633,[M-H]-,30.0,val,O=c1[nH]nc(SCc2cc(Cl)ccc2Cl)c(=O)[nH]1
447492,O=c1[nH]nc(SCc2c(Cl)ccc(Cl)c2)c(=O)[nH]1,301.95633,[M-H]-,20.0,val,O=c1[nH]nc(SCc2cc(Cl)ccc2Cl)c(=O)[nH]1
447493,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447494,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447495,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,60.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447496,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,15.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447497,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447498,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,60.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447499,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,15.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447500,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,222.04844,[M-H]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447501,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,258.02512,[M+Cl]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447502,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,258.02512,[M+Cl]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447503,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,258.02512,[M+Cl]-,15.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447504,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,258.02512,[M+Cl]-,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447505,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,206.05243,[M+H-H2O]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447506,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,206.05243,[M+H-H2O]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447507,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,206.05243,[M+H-H2O]+,60.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447508,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,206.05243,[M+H-H2O]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447509,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,206.05243,[M+H-H2O]+,45.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447510,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447511,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447512,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,60.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447513,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,30.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447514,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447515,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,60.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447516,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,30.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447517,O=C(Nc1ccn[nH]1)c1c(F)cccc1F,224.06299,[M+H]+,20.0,val,O=C(Nc1ccn[nH]1)c1c(F)cccc1F
447518,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447519,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447520,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,60.0,val,Clc1ccccc1Cn1cc(I)cn1
447521,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,30.0,val,Clc1ccccc1Cn1cc(I)cn1
447522,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447523,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447524,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447525,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,60.0,val,Clc1ccccc1Cn1cc(I)cn1
447526,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,30.0,val,Clc1ccccc1Cn1cc(I)cn1
447527,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447528,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,60.0,val,Clc1ccccc1Cn1cc(I)cn1
447529,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,20.0,val,Clc1ccccc1Cn1cc(I)cn1
447530,Clc1ccccc1Cn1cc(I)cn1,318.94935,[M+H]+,30.0,val,Clc1ccccc1Cn1cc(I)cn1
447531,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,239.98915,[M-H]-,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447532,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,239.98915,[M-H]-,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447533,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,239.98915,[M-H]-,60.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447534,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,239.98915,[M-H]-,30.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447535,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,239.98915,[M-H]-,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447536,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447537,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447538,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,30.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447539,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,60.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447540,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447541,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,45.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447542,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,60.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447543,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,223.99314,[M+H-H2O]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447544,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447545,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447546,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,60.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447547,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,30.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447548,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447549,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,60.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447550,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,30.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447551,O=C(O)CCc1nc2c(ccc(Cl)c2)s1,242.0037,[M+H]+,20.0,val,O=C(O)CCc1nc2cc(Cl)ccc2s1
447552,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447553,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447554,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,60.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447555,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,30.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447556,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447557,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,60.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447558,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,30.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447559,O=C(O)C1Cc2c(cc(OC(F)F)cc2)O1,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2ccc(OC(F)F)cc2O1
447560,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447561,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447562,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,60.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447563,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,30.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447564,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447565,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,60.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447566,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,30.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447567,O=C(O)C1Cc2c(O1)c(OC(F)F)ccc2,229.03179,[M-H]-,20.0,val,O=C(O)C1Cc2cccc(OC(F)F)c2O1
447568,Cc1cc2c(cc1)oc(=O)cc2,161.0597,[M+H]+,20.0,val,Cc1ccc2oc(=O)ccc2c1
447569,Cc1cc2c(cc1)oc(=O)cc2,161.0597,[M+H]+,20.0,val,Cc1ccc2oc(=O)ccc2c1
447570,Cc1cc2c(cc1)oc(=O)cc2,161.0597,[M+H]+,60.0,val,Cc1ccc2oc(=O)ccc2c1
447571,Cc1cc2c(cc1)oc(=O)cc2,161.0597,[M+H]+,20.0,val,Cc1ccc2oc(=O)ccc2c1
447572,Cc1cc2c(cc1)oc(=O)cc2,161.0597,[M+H]+,45.0,val,Cc1ccc2oc(=O)ccc2c1
447573,Nc1nnc(CSCc2c(Cl)cc(Cl)cc2)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447574,Nc1nnc(CSCc2c(Cl)cc(Cl)cc2)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447575,Nc1nnc(CSCc2c(Cl)cc(Cl)cc2)s1,305.96877,[M+H]+,60.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447576,Nc1nnc(CSCc2c(Cl)cc(Cl)cc2)s1,305.96877,[M+H]+,30.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447577,Nc1nnc(CSCc2c(Cl)cc(Cl)cc2)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447578,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447579,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447580,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,60.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447581,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,30.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447582,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447583,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,20.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447584,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,30.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447585,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1,305.96877,[M+H]+,60.0,val,Nc1nnc(CSCc2ccc(Cl)cc2Cl)s1
447586,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447587,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447588,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447589,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447590,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447591,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447592,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447593,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,302.96704,[M-H]-,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447594,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,304.98159,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447595,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,304.98159,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447596,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,304.98159,[M+H]+,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447597,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,304.98159,[M+H]+,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447598,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl,304.98159,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)ccc1Cl
447599,c1coc(CNc2c3[nH]cnc3ncn2)c1,214.07343,[M-H]-,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447600,c1coc(CNc2c3[nH]cnc3ncn2)c1,214.07343,[M-H]-,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447601,c1coc(CNc2c3[nH]cnc3ncn2)c1,214.07343,[M-H]-,60.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447602,c1coc(CNc2c3[nH]cnc3ncn2)c1,214.07343,[M-H]-,30.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447603,c1coc(CNc2c3[nH]cnc3ncn2)c1,214.07343,[M-H]-,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447604,c1coc(CNc2c3[nH]cnc3ncn2)c1,216.08799,[M+H]+,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447605,c1coc(CNc2c3[nH]cnc3ncn2)c1,216.08799,[M+H]+,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447606,c1coc(CNc2c3[nH]cnc3ncn2)c1,216.08799,[M+H]+,60.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447607,c1coc(CNc2c3[nH]cnc3ncn2)c1,216.08799,[M+H]+,30.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447608,c1coc(CNc2c3[nH]cnc3ncn2)c1,216.08799,[M+H]+,20.0,val,c1coc(CNc2ncnc3nc[nH]c23)c1
447609,CCn1ncc(Br)c1C(=O)Nc1ncc(Cl)cc1,328.97993,[M+H]+,20.0,val,CCn1ncc(Br)c1C(=O)Nc1ccc(Cl)cn1
447610,CCn1ncc(Br)c1C(=O)Nc1ncc(Cl)cc1,328.97993,[M+H]+,20.0,val,CCn1ncc(Br)c1C(=O)Nc1ccc(Cl)cn1
447611,CCn1ncc(Br)c1C(=O)Nc1ncc(Cl)cc1,328.97993,[M+H]+,60.0,val,CCn1ncc(Br)c1C(=O)Nc1ccc(Cl)cn1
447612,CCn1ncc(Br)c1C(=O)Nc1ncc(Cl)cc1,328.97993,[M+H]+,30.0,val,CCn1ncc(Br)c1C(=O)Nc1ccc(Cl)cn1
447613,CCn1ncc(Br)c1C(=O)Nc1ncc(Cl)cc1,328.97993,[M+H]+,20.0,val,CCn1ncc(Br)c1C(=O)Nc1ccc(Cl)cn1
447614,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C,328.97993,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C
447615,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C,328.97993,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C
447616,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C,328.97993,[M+H]+,60.0,val,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C
447617,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C,328.97993,[M+H]+,30.0,val,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C
447618,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C,328.97993,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)Nc2cccnc2Cl)nn1C
447619,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,301.01522,[M+FA]-,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447620,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,301.01522,[M+FA]-,60.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447621,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,301.01522,[M+FA]-,15.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447622,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,301.01522,[M+FA]-,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447623,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447624,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447625,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,60.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447626,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,30.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447627,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447628,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,30.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447629,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,60.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447630,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl,257.02429,[M+H]+,20.0,val,OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
447631,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,20.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447632,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,20.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447633,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,60.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447634,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,20.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447635,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,60.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447636,CNc1nc(N)nc(-c2c(Cl)c(Cl)ccc2)c1,269.03553,[M+H]+,20.0,val,CNc1cc(-c2cccc(Cl)c2Cl)nc(N)n1
447637,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,20.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447638,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,20.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447639,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,60.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447640,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,20.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447641,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,60.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447642,Cc1c(-c2cc(Cl)c(Cl)cc2)c(N)nc(N)n1,269.03553,[M+H]+,20.0,val,Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1
447643,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,250.03888,[M-H]-,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447644,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,250.03888,[M-H]-,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447645,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,250.03888,[M-H]-,60.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447646,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,250.03888,[M-H]-,15.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447647,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,250.03888,[M-H]-,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447648,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447649,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447650,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,15.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447651,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447652,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,15.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447653,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,250.03888,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447654,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,20.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447655,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,20.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447656,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,60.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447657,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,20.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447658,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,45.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447659,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,60.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447660,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,252.05343,[M+H]+,20.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447661,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,274.03537,[M+Na]+,45.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447662,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,274.03537,[M+Na]+,45.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447663,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,274.03537,[M+Na]+,20.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447664,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,274.03537,[M+Na]+,60.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447665,CCc1nc(C(=O)O)nn1-c1ccccc1Cl,274.03537,[M+Na]+,45.0,val,CCc1nc(C(=O)O)nn1-c1ccccc1Cl
447666,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447667,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447668,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,60.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447669,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,30.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447670,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447671,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,60.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447672,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,30.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447673,CCc1c(C(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,CCc1c(C(=O)O)nnn1-c1cccc(Cl)c1
447674,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447675,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447676,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,60.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447677,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,30.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447678,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447679,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,60.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447680,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,30.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447681,Cc1c(CC(=O)O)nnn1-c1cc(Cl)ccc1,252.05343,[M+H]+,20.0,val,Cc1c(CC(=O)O)nnn1-c1cccc(Cl)c1
447682,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447683,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447684,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,30.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447685,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447686,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,15.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447687,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447688,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447689,Cc1nn(-c2nc(C(=O)O)c(Cl)cc2)c(C)c1,252.05343,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(Cl)c(C(=O)O)n2)n1
447690,CC1=NC(C)C(=O)Nc2c1ccc(Br)c2,267.01275,[M+H]+,20.0,val,CC1=NC(C)C(=O)Nc2cc(Br)ccc21
447691,CC1=NC(C)C(=O)Nc2c1ccc(Br)c2,267.01275,[M+H]+,20.0,val,CC1=NC(C)C(=O)Nc2cc(Br)ccc21
447692,CC1=NC(C)C(=O)Nc2c1ccc(Br)c2,267.01275,[M+H]+,60.0,val,CC1=NC(C)C(=O)Nc2cc(Br)ccc21
447693,CC1=NC(C)C(=O)Nc2c1ccc(Br)c2,267.01275,[M+H]+,20.0,val,CC1=NC(C)C(=O)Nc2cc(Br)ccc21
447694,CC1=NC(C)C(=O)Nc2c1ccc(Br)c2,267.01275,[M+H]+,45.0,val,CC1=NC(C)C(=O)Nc2cc(Br)ccc21
447695,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,20.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447696,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,20.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447697,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,60.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447698,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,30.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447699,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,20.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447700,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,30.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447701,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,20.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447702,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,312.98294,[M-H]-,60.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447703,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,314.9975,[M+H]+,30.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447704,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,314.9975,[M+H]+,30.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447705,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,314.9975,[M+H]+,60.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447706,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,314.9975,[M+H]+,20.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447707,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,314.9975,[M+H]+,30.0,val,CC(O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2
447708,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447709,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447710,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447711,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,30.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447712,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447713,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447714,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447715,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,340.97133,[M-H]-,30.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447716,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,376.94801,[M+Cl]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447717,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,376.94801,[M+Cl]-,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447718,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,376.94801,[M+Cl]-,15.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447719,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,376.94801,[M+Cl]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447720,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,386.97681,[M+FA]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447721,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,386.97681,[M+FA]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447722,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,386.97681,[M+FA]-,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447723,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,386.97681,[M+FA]-,15.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447724,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,386.97681,[M+FA]-,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447725,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447726,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447727,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447728,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,15.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447729,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447730,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,45.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447731,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447732,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1,342.98588,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc(Br)o3)C2)s1
447733,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,20.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447734,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,20.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447735,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,60.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447736,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,30.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447737,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,20.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447738,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,20.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447739,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,30.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447740,O=C(O)CC(CC(=O)O)c1ccccc1Br,284.97679,[M-H]-,60.0,val,O=C(O)CC(CC(=O)O)c1ccccc1Br
447741,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447742,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447743,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447744,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447745,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447746,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447747,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447748,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,332.9776,[M-H]-,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447749,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,334.99215,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447750,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,334.99215,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447751,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,334.99215,[M+H]+,60.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447752,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,334.99215,[M+H]+,30.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447753,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl,334.99215,[M+H]+,20.0,val,COc1cc(S(=O)(=O)Nc2nccs2)c(OC)cc1Cl
447754,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,321.07038,[M+FA]-,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447755,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,321.07038,[M+FA]-,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447756,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,321.07038,[M+FA]-,60.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447757,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,321.07038,[M+FA]-,15.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447758,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,321.07038,[M+FA]-,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447759,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447760,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447761,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,60.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447762,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447763,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,45.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447764,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,60.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447765,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,20.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447766,O=C(c1cc(OCC(F)(F)F)ncc1)N1CC(O)C1,277.07945,[M+H]+,45.0,val,O=C(c1ccnc(OCC(F)(F)F)c1)N1CC(O)C1
447767,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447768,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447769,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447770,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447771,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,45.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447772,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447773,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447774,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,45.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447775,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447776,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447777,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447778,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,15.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447779,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447780,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447781,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447782,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447783,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447784,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,45.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447785,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447786,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447787,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,275.0649,[M-H]-,45.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447788,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447789,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447790,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447791,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,15.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447792,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447793,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,45.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447794,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,60.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447795,CC(C)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,311.04158,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447796,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447797,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447798,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,60.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447799,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,30.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447800,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447801,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,60.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447802,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,30.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447803,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,291.05982,[M-H]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447804,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447805,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447806,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,60.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447807,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,15.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447808,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447809,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,60.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447810,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,15.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447811,CC(C)(O)C(=O)Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1,327.03649,[M+Cl]-,20.0,val,CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1
447812,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1,317.07908,[M+H]+,20.0,val,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1
447813,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1,317.07908,[M+H]+,20.0,val,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1
447814,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1,317.07908,[M+H]+,60.0,val,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1
447815,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1,317.07908,[M+H]+,30.0,val,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1
447816,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1,317.07908,[M+H]+,20.0,val,Cc1nnc(N2CC(Nc3nccc(C(F)(F)F)n3)C2)s1
447817,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,20.0,val,Cc1ccc2nc(C)ccc2c1
447818,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,20.0,val,Cc1ccc2nc(C)ccc2c1
447819,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,60.0,val,Cc1ccc2nc(C)ccc2c1
447820,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,20.0,val,Cc1ccc2nc(C)ccc2c1
447821,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,75.0,val,Cc1ccc2nc(C)ccc2c1
447822,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,60.0,val,Cc1ccc2nc(C)ccc2c1
447823,Cc1cc2c(cc1)nc(C)cc2,158.09642,[M+H]+,20.0,val,Cc1ccc2nc(C)ccc2c1
447824,Cc1c2ccn(CC(=O)O)c2ccc1,188.0717,[M-H]-,20.0,val,Cc1cccc2c1ccn2CC(=O)O
447825,Cc1c2ccn(CC(=O)O)c2ccc1,188.0717,[M-H]-,20.0,val,Cc1cccc2c1ccn2CC(=O)O
447826,Cc1c2ccn(CC(=O)O)c2ccc1,188.0717,[M-H]-,60.0,val,Cc1cccc2c1ccn2CC(=O)O
447827,Cc1c2ccn(CC(=O)O)c2ccc1,188.0717,[M-H]-,15.0,val,Cc1cccc2c1ccn2CC(=O)O
447828,Cc1c2ccn(CC(=O)O)c2ccc1,188.0717,[M-H]-,20.0,val,Cc1cccc2c1ccn2CC(=O)O
447829,Cc1cc2c(cc1)[nH]c(C(=O)O)c2C,188.0717,[M-H]-,20.0,val,Cc1ccc2[nH]c(C(=O)O)c(C)c2c1
447830,Cc1cc2c(cc1)[nH]c(C(=O)O)c2C,188.0717,[M-H]-,20.0,val,Cc1ccc2[nH]c(C(=O)O)c(C)c2c1
447831,Cc1cc2c(cc1)[nH]c(C(=O)O)c2C,188.0717,[M-H]-,60.0,val,Cc1ccc2[nH]c(C(=O)O)c(C)c2c1
447832,Cc1cc2c(cc1)[nH]c(C(=O)O)c2C,188.0717,[M-H]-,30.0,val,Cc1ccc2[nH]c(C(=O)O)c(C)c2c1
447833,Cc1cc2c(cc1)[nH]c(C(=O)O)c2C,188.0717,[M-H]-,20.0,val,Cc1ccc2[nH]c(C(=O)O)c(C)c2c1
447834,O=C(O)CCn1ccc2ccccc21,188.0717,[M-H]-,20.0,val,O=C(O)CCn1ccc2ccccc21
447835,O=C(O)CCn1ccc2ccccc21,188.0717,[M-H]-,20.0,val,O=C(O)CCn1ccc2ccccc21
447836,O=C(O)CCn1ccc2ccccc21,188.0717,[M-H]-,60.0,val,O=C(O)CCn1ccc2ccccc21
447837,O=C(O)CCn1ccc2ccccc21,188.0717,[M-H]-,15.0,val,O=C(O)CCn1ccc2ccccc21
447838,O=C(O)CCn1ccc2ccccc21,188.0717,[M-H]-,20.0,val,O=C(O)CCn1ccc2ccccc21
447839,Cc1cc2ccccc2n1CC(=O)O,188.0717,[M-H]-,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447840,Cc1cc2ccccc2n1CC(=O)O,188.0717,[M-H]-,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447841,Cc1cc2ccccc2n1CC(=O)O,188.0717,[M-H]-,60.0,val,Cc1cc2ccccc2n1CC(=O)O
447842,Cc1cc2ccccc2n1CC(=O)O,188.0717,[M-H]-,15.0,val,Cc1cc2ccccc2n1CC(=O)O
447843,Cc1cc2ccccc2n1CC(=O)O,188.0717,[M-H]-,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447844,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447845,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447846,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,60.0,val,Cc1cc2ccccc2n1CC(=O)O
447847,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,30.0,val,Cc1cc2ccccc2n1CC(=O)O
447848,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447849,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,60.0,val,Cc1cc2ccccc2n1CC(=O)O
447850,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,30.0,val,Cc1cc2ccccc2n1CC(=O)O
447851,Cc1cc2ccccc2n1CC(=O)O,190.08625,[M+H]+,20.0,val,Cc1cc2ccccc2n1CC(=O)O
447852,O=C(O)c1ccc(N2CC=CC2)cc1,190.08625,[M+H]+,20.0,val,O=C(O)c1ccc(N2CC=CC2)cc1
447853,O=C(O)c1ccc(N2CC=CC2)cc1,190.08625,[M+H]+,20.0,val,O=C(O)c1ccc(N2CC=CC2)cc1
447854,O=C(O)c1ccc(N2CC=CC2)cc1,190.08625,[M+H]+,60.0,val,O=C(O)c1ccc(N2CC=CC2)cc1
447855,O=C(O)c1ccc(N2CC=CC2)cc1,190.08625,[M+H]+,30.0,val,O=C(O)c1ccc(N2CC=CC2)cc1
447856,O=C(O)c1ccc(N2CC=CC2)cc1,190.08625,[M+H]+,20.0,val,O=C(O)c1ccc(N2CC=CC2)cc1
447857,O=C(O)CCn1ccc2ccccc21,190.08625,[M+H]+,20.0,val,O=C(O)CCn1ccc2ccccc21
447858,O=C(O)CCn1ccc2ccccc21,190.08625,[M+H]+,20.0,val,O=C(O)CCn1ccc2ccccc21
447859,O=C(O)CCn1ccc2ccccc21,190.08625,[M+H]+,60.0,val,O=C(O)CCn1ccc2ccccc21
447860,O=C(O)CCn1ccc2ccccc21,190.08625,[M+H]+,30.0,val,O=C(O)CCn1ccc2ccccc21
447861,O=C(O)CCn1ccc2ccccc21,190.08625,[M+H]+,20.0,val,O=C(O)CCn1ccc2ccccc21
447862,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,30.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447863,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,30.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447864,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,20.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447865,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,60.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447866,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,30.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447867,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,20.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447868,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,20.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447869,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,60.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447870,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,15.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447871,C#Cc1ccc(C[C@H](N)C(=O)O)cc1,190.08625,[M+H]+,20.0,val,C#Cc1ccc(C[C@H](N)C(=O)O)cc1
447872,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,256.03821,[M-H]-,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447873,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,256.03821,[M-H]-,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447874,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,256.03821,[M-H]-,60.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447875,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,256.03821,[M-H]-,30.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447876,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,256.03821,[M-H]-,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447877,COC(C)C(=O)Nc1cc(C(=O)O)c(Cl)cc1,256.03821,[M-H]-,20.0,val,COC(C)C(=O)Nc1ccc(Cl)c(C(=O)O)c1
447878,COC(C)C(=O)Nc1cc(C(=O)O)c(Cl)cc1,256.03821,[M-H]-,20.0,val,COC(C)C(=O)Nc1ccc(Cl)c(C(=O)O)c1
447879,COC(C)C(=O)Nc1cc(C(=O)O)c(Cl)cc1,256.03821,[M-H]-,60.0,val,COC(C)C(=O)Nc1ccc(Cl)c(C(=O)O)c1
447880,COC(C)C(=O)Nc1cc(C(=O)O)c(Cl)cc1,256.03821,[M-H]-,15.0,val,COC(C)C(=O)Nc1ccc(Cl)c(C(=O)O)c1
447881,COC(C)C(=O)Nc1cc(C(=O)O)c(Cl)cc1,256.03821,[M-H]-,20.0,val,COC(C)C(=O)Nc1ccc(Cl)c(C(=O)O)c1
447882,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,258.05276,[M+H]+,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447883,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,258.05276,[M+H]+,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447884,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,258.05276,[M+H]+,60.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447885,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,258.05276,[M+H]+,15.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447886,CN(CCC(=O)O)C(=O)c1c(Cl)ccc(O)c1,258.05276,[M+H]+,20.0,val,CN(CCC(=O)O)C(=O)c1cc(O)ccc1Cl
447887,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,20.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447888,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,20.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447889,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,60.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447890,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,20.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447891,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,60.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447892,FC(F)(F)COc1nc(N2CCOCC2)nc(OCC(F)(F)F)n1,363.08864,[M+H]+,20.0,val,FC(F)(F)COc1nc(OCC(F)(F)F)nc(N2CCOCC2)n1
447893,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,259.0949,[M-H]-,20.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447894,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,259.0949,[M-H]-,20.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447895,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,259.0949,[M-H]-,60.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447896,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,259.0949,[M-H]-,15.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447897,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,259.0949,[M-H]-,20.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447898,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,305.10038,[M+FA]-,15.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447899,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,305.10038,[M+FA]-,15.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447900,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,305.10038,[M+FA]-,20.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447901,O=C(O)c1cn(C2CCN(c3nccnc3)C2)nn1,305.10038,[M+FA]-,15.0,val,O=C(O)c1cn(C2CCN(c3cnccn3)C2)nn1
447902,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,223.0612,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447903,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,223.0612,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447904,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,223.0612,[M-H]-,60.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447905,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,223.0612,[M-H]-,30.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447906,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,223.0612,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447907,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447908,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447909,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,60.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447910,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,30.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447911,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447912,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447913,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447914,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,60.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447915,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,15.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447916,COc1cc2c(C(=O)OC(C)C2O)c(O)c1,269.06668,[M+FA]-,20.0,val,COc1cc(O)c2c(c1)C(O)C(C)OC2=O
447917,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1,319.01609,[M-H]-,30.0,val,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1
447918,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1,319.01609,[M-H]-,30.0,val,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1
447919,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1,319.01609,[M-H]-,20.0,val,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1
447920,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1,319.01609,[M-H]-,60.0,val,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1
447921,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1,319.01609,[M-H]-,30.0,val,CN(CCC(=O)O)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1
447922,FC(F)(F)Oc1ccc(N2CCNCC2)cc1,247.10527,[M+H]+,20.0,val,FC(F)(F)Oc1ccc(N2CCNCC2)cc1
447923,FC(F)(F)Oc1ccc(N2CCNCC2)cc1,247.10527,[M+H]+,20.0,val,FC(F)(F)Oc1ccc(N2CCNCC2)cc1
447924,FC(F)(F)Oc1ccc(N2CCNCC2)cc1,247.10527,[M+H]+,45.0,val,FC(F)(F)Oc1ccc(N2CCNCC2)cc1
447925,FC(F)(F)Oc1ccc(N2CCNCC2)cc1,247.10527,[M+H]+,60.0,val,FC(F)(F)Oc1ccc(N2CCNCC2)cc1
447926,FC(F)(F)Oc1ccc(N2CCNCC2)cc1,247.10527,[M+H]+,20.0,val,FC(F)(F)Oc1ccc(N2CCNCC2)cc1
447927,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447928,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447929,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,60.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447930,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,30.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447931,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447932,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,60.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447933,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,30.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447934,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,261.08564,[M-H]-,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447935,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447936,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447937,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,60.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447938,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,30.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447939,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447940,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,60.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447941,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,30.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447942,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2,263.10019,[M+H]+,20.0,val,CCC(C(=O)O)n1nc(C(F)(F)F)c2c1CCC2
447943,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,374.99596,[M-H]-,30.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447944,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,374.99596,[M-H]-,30.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447945,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,374.99596,[M-H]-,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447946,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,374.99596,[M-H]-,60.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447947,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,374.99596,[M-H]-,30.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447948,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,421.00144,[M+FA]-,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447949,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,421.00144,[M+FA]-,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447950,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,421.00144,[M+FA]-,60.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447951,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,421.00144,[M+FA]-,15.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447952,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,421.00144,[M+FA]-,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447953,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447954,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447955,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,60.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447956,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,30.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447957,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447958,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,60.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447959,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,30.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447960,Nc1c2c(I)cn([C@H]3C[C@H](O)[C@@H](CO)O3)c2ncn1,377.01051,[M+H]+,20.0,val,Nc1ncnc2c1c(I)cn2[C@H]1C[C@H](O)[C@@H](CO)O1
447961,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447962,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447963,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,60.0,val,C#CCN(C)Cc1ccccc1
447964,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,30.0,val,C#CCN(C)Cc1ccccc1
447965,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447966,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447967,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447968,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,60.0,val,C#CCN(C)Cc1ccccc1
447969,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,15.0,val,C#CCN(C)Cc1ccccc1
447970,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447971,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,60.0,val,C#CCN(C)Cc1ccccc1
447972,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,15.0,val,C#CCN(C)Cc1ccccc1
447973,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447974,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447975,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447976,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,60.0,val,C#CCN(C)Cc1ccccc1
447977,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,30.0,val,C#CCN(C)Cc1ccccc1
447978,C#CCN(C)Cc1ccccc1,160.11208,[M+H]+,20.0,val,C#CCN(C)Cc1ccccc1
447979,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,20.0,val,CSCCNc1nc(-c2cccnc2)cs1
447980,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,20.0,val,CSCCNc1nc(-c2cccnc2)cs1
447981,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,60.0,val,CSCCNc1nc(-c2cccnc2)cs1
447982,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,20.0,val,CSCCNc1nc(-c2cccnc2)cs1
447983,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,45.0,val,CSCCNc1nc(-c2cccnc2)cs1
447984,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,60.0,val,CSCCNc1nc(-c2cccnc2)cs1
447985,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,20.0,val,CSCCNc1nc(-c2cccnc2)cs1
447986,CSCCNc1nc(-c2cnccc2)cs1,252.06236,[M+H]+,45.0,val,CSCCNc1nc(-c2cccnc2)cs1
447987,C=CCN(CC=C)S(=O)(=O)c1c(C(=O)O)scc1,286.02132,[M-H]-,20.0,val,C=CCN(CC=C)S(=O)(=O)c1ccsc1C(=O)O
447988,C=CCN(CC=C)S(=O)(=O)c1c(C(=O)O)scc1,286.02132,[M-H]-,20.0,val,C=CCN(CC=C)S(=O)(=O)c1ccsc1C(=O)O
447989,C=CCN(CC=C)S(=O)(=O)c1c(C(=O)O)scc1,286.02132,[M-H]-,60.0,val,C=CCN(CC=C)S(=O)(=O)c1ccsc1C(=O)O
447990,C=CCN(CC=C)S(=O)(=O)c1c(C(=O)O)scc1,286.02132,[M-H]-,30.0,val,C=CCN(CC=C)S(=O)(=O)c1ccsc1C(=O)O
447991,C=CCN(CC=C)S(=O)(=O)c1c(C(=O)O)scc1,286.02132,[M-H]-,20.0,val,C=CCN(CC=C)S(=O)(=O)c1ccsc1C(=O)O
447992,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,349.95257,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447993,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,349.95257,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447994,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,349.95257,[M-H]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447995,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,349.95257,[M-H]-,30.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447996,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,349.95257,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447997,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,333.95656,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447998,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,333.95656,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
447999,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,333.95656,[M+H-H2O]+,60.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
448000,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,333.95656,[M+H-H2O]+,30.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
448001,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1,333.95656,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1ccc(Br)o1
448002,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,20.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448003,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,20.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448004,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,60.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448005,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,30.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448006,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,20.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448007,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,60.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448008,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,30.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448009,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1,252.10105,[M+H]+,20.0,val,CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1
448010,NC(=O)OCC(COC(N)=O)c1ccccc1,261.08458,[M+Na]+,20.0,val,NC(=O)OCC(COC(N)=O)c1ccccc1
448011,NC(=O)OCC(COC(N)=O)c1ccccc1,261.08458,[M+Na]+,20.0,val,NC(=O)OCC(COC(N)=O)c1ccccc1
448012,NC(=O)OCC(COC(N)=O)c1ccccc1,261.08458,[M+Na]+,30.0,val,NC(=O)OCC(COC(N)=O)c1ccccc1
448013,NC(=O)OCC(COC(N)=O)c1ccccc1,261.08458,[M+Na]+,60.0,val,NC(=O)OCC(COC(N)=O)c1ccccc1
448014,NC(=O)OCC(COC(N)=O)c1ccccc1,261.08458,[M+Na]+,20.0,val,NC(=O)OCC(COC(N)=O)c1ccccc1
448015,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,239.10263,[M+H]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448016,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,239.10263,[M+H]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448017,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,239.10263,[M+H]+,60.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448018,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,239.10263,[M+H]+,15.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448019,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,239.10263,[M+H]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448020,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,256.12918,[M+NH4]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448021,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,256.12918,[M+NH4]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448022,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,256.12918,[M+NH4]+,60.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448023,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,256.12918,[M+NH4]+,15.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448024,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,256.12918,[M+NH4]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448025,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,261.08458,[M+Na]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448026,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,261.08458,[M+Na]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448027,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,261.08458,[M+Na]+,60.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448028,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,261.08458,[M+Na]+,30.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448029,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1,261.08458,[M+Na]+,20.0,val,COC(=O)Nc1ccc(C)c(NC(=O)OC)c1
448030,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,20.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448031,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,20.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448032,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,60.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448033,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,30.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448034,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,20.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448035,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,30.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448036,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,20.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448037,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1,329.02061,[M-H]-,60.0,val,CCSc1nnc(NC(=O)CSc2nc(C)c(C)o2)s1
448038,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,301.07091,[M+Cl]-,15.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448039,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,301.07091,[M+Cl]-,15.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448040,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,301.07091,[M+Cl]-,20.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448041,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,301.07091,[M+Cl]-,15.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448042,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,265.09423,[M-H]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448043,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,265.09423,[M-H]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448044,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,265.09423,[M-H]-,60.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448045,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,265.09423,[M-H]-,30.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448046,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,265.09423,[M-H]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448047,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,301.07091,[M+Cl]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448048,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,301.07091,[M+Cl]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448049,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,301.07091,[M+Cl]-,15.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448050,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,301.07091,[M+Cl]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448051,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,311.09971,[M+FA]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448052,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,311.09971,[M+FA]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448053,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,311.09971,[M+FA]-,60.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448054,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,311.09971,[M+FA]-,15.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448055,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,311.09971,[M+FA]-,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448056,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448057,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448058,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,60.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448059,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,30.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448060,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448061,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,60.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448062,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,30.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448063,Nc1c2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ncn1,267.10878,[M+H]+,20.0,val,Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448064,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,20.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448065,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,20.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448066,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,60.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448067,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,30.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448068,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,20.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448069,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,60.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448070,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,30.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448071,Nc1c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2ccn1,267.10878,[M+H]+,20.0,val,Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
448072,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448073,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448074,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448075,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448076,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448077,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448078,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448079,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,60.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448080,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,30.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448081,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448082,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,60.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448083,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,30.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448084,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,265.09423,[M-H]-,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448085,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,267.10878,[M+H]+,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448086,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,267.10878,[M+H]+,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448087,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,267.10878,[M+H]+,60.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448088,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,267.10878,[M+H]+,30.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448089,O=c1nc[nH]c2c1[nH]cc2[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O,267.10878,[M+H]+,20.0,val,O=c1nc[nH]c2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
448090,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448091,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448092,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448093,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448094,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448095,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448096,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448097,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O,267.10878,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O
448098,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448099,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448100,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,60.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448101,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,30.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448102,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448103,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,60.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448104,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,30.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448105,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,297.0663,[M-H]-,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448106,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448107,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448108,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,60.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448109,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,15.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448110,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448111,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,60.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448112,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,15.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448113,CSCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,299.08085,[M+H]+,20.0,val,CSCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448114,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,317.06582,[M+Cl]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448115,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,317.06582,[M+Cl]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448116,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,317.06582,[M+Cl]-,60.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448117,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,317.06582,[M+Cl]-,15.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448118,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,317.06582,[M+Cl]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448119,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,327.09462,[M+FA]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448120,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,327.09462,[M+FA]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448121,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,327.09462,[M+FA]-,60.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448122,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,327.09462,[M+FA]-,15.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448123,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,327.09462,[M+FA]-,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448124,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,283.1037,[M+H]+,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448125,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,283.1037,[M+H]+,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448126,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,283.1037,[M+H]+,60.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448127,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,283.1037,[M+H]+,15.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448128,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O,283.1037,[M+H]+,20.0,val,Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O
448129,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,281.08914,[M-H]-,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448130,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,281.08914,[M-H]-,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448131,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,281.08914,[M-H]-,60.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448132,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,281.08914,[M-H]-,30.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448133,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,281.08914,[M-H]-,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448134,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,283.1037,[M+H]+,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448135,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,283.1037,[M+H]+,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448136,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,283.1037,[M+H]+,60.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448137,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,283.1037,[M+H]+,15.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448138,COCC1OC(n2cnc3c2[nH]cnc3=O)C(O)C1O,283.1037,[M+H]+,20.0,val,COCC1OC(n2cnc3c(=O)nc[nH]c32)C(O)C1O
448139,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448140,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448141,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,60.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448142,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,30.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448143,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448144,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,60.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448145,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,30.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448146,CSc1n[nH]c(NCc2cccc(C)c2)n1,233.08664,[M-H]-,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448147,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448148,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448149,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,60.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448150,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,30.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448151,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448152,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,60.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448153,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,30.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448154,CSc1n[nH]c(NCc2cccc(C)c2)n1,235.10119,[M+H]+,20.0,val,CSc1n[nH]c(NCc2cccc(C)c2)n1
448155,C/C(=N\NC(=S)N1CCC1)c1ccccn1,235.10119,[M+H]+,15.0,val,C/C(=N\NC(=S)N1CCC1)c1ccccn1
448156,C/C(=N\NC(=S)N1CCC1)c1ccccn1,235.10119,[M+H]+,15.0,val,C/C(=N\NC(=S)N1CCC1)c1ccccn1
448157,C/C(=N\NC(=S)N1CCC1)c1ccccn1,235.10119,[M+H]+,20.0,val,C/C(=N\NC(=S)N1CCC1)c1ccccn1
448158,C/C(=N\NC(=S)N1CCC1)c1ccccn1,235.10119,[M+H]+,60.0,val,C/C(=N\NC(=S)N1CCC1)c1ccccn1
448159,C/C(=N\NC(=S)N1CCC1)c1ccccn1,235.10119,[M+H]+,15.0,val,C/C(=N\NC(=S)N1CCC1)c1ccccn1
448160,CCCCOC(=O)c1ccc(O)cc1,193.08702,[M-H]-,20.0,val,CCCCOC(=O)c1ccc(O)cc1
448161,CCCCOC(=O)c1ccc(O)cc1,193.08702,[M-H]-,20.0,val,CCCCOC(=O)c1ccc(O)cc1
448162,CCCCOC(=O)c1ccc(O)cc1,193.08702,[M-H]-,30.0,val,CCCCOC(=O)c1ccc(O)cc1
448163,CCCCOC(=O)c1ccc(O)cc1,193.08702,[M-H]-,20.0,val,CCCCOC(=O)c1ccc(O)cc1
448164,COc1c(O)ccc(CCC(C)=O)c1,212.12812,[M+NH4]+,20.0,val,COc1cc(CCC(C)=O)ccc1O
448165,COc1c(O)ccc(CCC(C)=O)c1,212.12812,[M+NH4]+,20.0,val,COc1cc(CCC(C)=O)ccc1O
448166,COc1c(O)ccc(CCC(C)=O)c1,212.12812,[M+NH4]+,60.0,val,COc1cc(CCC(C)=O)ccc1O
448167,COc1c(O)ccc(CCC(C)=O)c1,212.12812,[M+NH4]+,15.0,val,COc1cc(CCC(C)=O)ccc1O
448168,COc1c(O)ccc(CCC(C)=O)c1,212.12812,[M+NH4]+,20.0,val,COc1cc(CCC(C)=O)ccc1O
448169,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448170,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448171,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,30.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448172,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,60.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448173,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448174,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,45.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448175,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,60.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448176,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448177,CC/C=C/c1c(C)oc(=O)cc1OC,195.10157,[M+H]+,45.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448178,CC/C=C/c1c(C)oc(=O)cc1OC,217.08351,[M+Na]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448179,CC/C=C/c1c(C)oc(=O)cc1OC,217.08351,[M+Na]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448180,CC/C=C/c1c(C)oc(=O)cc1OC,217.08351,[M+Na]+,60.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448181,CC/C=C/c1c(C)oc(=O)cc1OC,217.08351,[M+Na]+,30.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448182,CC/C=C/c1c(C)oc(=O)cc1OC,217.08351,[M+Na]+,20.0,val,CC/C=C/c1c(OC)cc(=O)oc1C
448183,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448184,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448185,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,60.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448186,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448187,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,45.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448188,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448189,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,301.04174,[M-H]-,45.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448190,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448191,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448192,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,60.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448193,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448194,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,45.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448195,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,60.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448196,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,20.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448197,CC(C)Cc1c(-c2ccc(P(=O)(O)O)o2)nc(N)s1,303.05629,[M+H]+,45.0,val,CC(C)Cc1sc(N)nc1-c1ccc(P(=O)(O)O)o1
448198,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448199,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448200,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,30.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448201,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448202,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,30.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448203,CN1CCN(c2nccc(C(=O)O)c2)CC1,220.10915,[M-H]-,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448204,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448205,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448206,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,60.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448207,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,30.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448208,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448209,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,60.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448210,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,30.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448211,O=C(O)c1cc(N2CCCNCC2)ncc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CCCNCC2)c1
448212,CN1CCN(c2nccc(C(=O)O)c2)CC1,222.1237,[M+H]+,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448213,CN1CCN(c2nccc(C(=O)O)c2)CC1,222.1237,[M+H]+,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448214,CN1CCN(c2nccc(C(=O)O)c2)CC1,222.1237,[M+H]+,60.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448215,CN1CCN(c2nccc(C(=O)O)c2)CC1,222.1237,[M+H]+,30.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448216,CN1CCN(c2nccc(C(=O)O)c2)CC1,222.1237,[M+H]+,20.0,val,CN1CCN(c2cc(C(=O)O)ccn2)CC1
448217,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448218,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448219,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,60.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448220,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,30.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448221,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448222,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,60.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448223,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,30.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448224,O=C(O)c1cnc(N2CCCNCC2)cc1,222.1237,[M+H]+,20.0,val,O=C(O)c1ccc(N2CCCNCC2)nc1
448225,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,20.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448226,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,20.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448227,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,60.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448228,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,20.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448229,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,45.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448230,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,60.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448231,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,20.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448232,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1,286.0856,[M+H]+,45.0,val,O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCC1
448233,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448234,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448235,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,60.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448236,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,30.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448237,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448238,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,60.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448239,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,30.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448240,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,284.08881,[M-H]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448241,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,320.06549,[M+Cl]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448242,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,320.06549,[M+Cl]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448243,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,320.06549,[M+Cl]-,60.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448244,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,320.06549,[M+Cl]-,15.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448245,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,320.06549,[M+Cl]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448246,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,330.09429,[M+FA]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448247,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,330.09429,[M+FA]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448248,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,330.09429,[M+FA]-,60.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448249,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,330.09429,[M+FA]-,15.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448250,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,330.09429,[M+FA]-,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448251,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,286.10336,[M+H]+,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448252,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,286.10336,[M+H]+,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448253,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,286.10336,[M+H]+,60.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448254,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,286.10336,[M+H]+,15.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448255,CC(=O)Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,286.10336,[M+H]+,20.0,val,CC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
448256,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448257,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448258,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,60.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448259,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,30.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448260,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448261,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,60.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448262,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,30.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448263,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,207.1139,[M-H]-,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448264,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448265,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448266,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,60.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448267,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,15.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448268,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448269,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,60.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448270,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,15.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448271,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,209.12845,[M+H]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448272,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,231.1104,[M+Na]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448273,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,231.1104,[M+Na]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448274,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,231.1104,[M+Na]+,60.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448275,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,231.1104,[M+Na]+,30.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448276,CC(C)(C)n1nc(C(=O)O)cc1C1CC1,231.1104,[M+Na]+,20.0,val,CC(C)(C)n1nc(C(=O)O)cc1C1CC1
448277,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448278,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448279,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,60.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448280,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,30.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448281,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448282,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,60.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448283,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,30.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448284,Cc1c(C(=O)O)cnn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1c(C(=O)O)cnn1C1CCCCC1
448285,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448286,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448287,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448288,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448289,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,45.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448290,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448291,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448292,Cn1cc(C(=O)O)c(C2CCCCC2)n1,209.12845,[M+H]+,45.0,val,Cn1cc(C(=O)O)c(C2CCCCC2)n1
448293,Cc1cc(C(=O)O)nn1C1CCCCC1,191.11789,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448294,Cc1cc(C(=O)O)nn1C1CCCCC1,191.11789,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448295,Cc1cc(C(=O)O)nn1C1CCCCC1,191.11789,[M+H-H2O]+,60.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448296,Cc1cc(C(=O)O)nn1C1CCCCC1,191.11789,[M+H-H2O]+,30.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448297,Cc1cc(C(=O)O)nn1C1CCCCC1,191.11789,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448298,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448299,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448300,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,30.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448301,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,60.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448302,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448303,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,45.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448304,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,30.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448305,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,60.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448306,Cc1cc(C(=O)O)nn1C1CCCCC1,209.12845,[M+H]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448307,Cc1cc(C(=O)O)nn1C1CCCCC1,231.1104,[M+Na]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448308,Cc1cc(C(=O)O)nn1C1CCCCC1,231.1104,[M+Na]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448309,Cc1cc(C(=O)O)nn1C1CCCCC1,231.1104,[M+Na]+,60.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448310,Cc1cc(C(=O)O)nn1C1CCCCC1,231.1104,[M+Na]+,30.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448311,Cc1cc(C(=O)O)nn1C1CCCCC1,231.1104,[M+Na]+,20.0,val,Cc1cc(C(=O)O)nn1C1CCCCC1
448312,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448313,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448314,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,60.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448315,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448316,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,45.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448317,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,60.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448318,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,20.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448319,CC(C)c1nc2c(CC(C(=O)O)CC2)[nH]1,209.12845,[M+H]+,45.0,val,CC(C)c1nc2c([nH]1)CC(C(=O)O)CC2
448320,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,20.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448321,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,20.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448322,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,60.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448323,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,30.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448324,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,20.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448325,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,60.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448326,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,30.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448327,CCc1c(C(=O)O)cnn1C1CCCC1,209.12845,[M+H]+,20.0,val,CCc1c(C(=O)O)cnn1C1CCCC1
448328,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,301.07874,[M+H]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448329,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,301.07874,[M+H]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448330,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,301.07874,[M+H]+,45.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448331,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,301.07874,[M+H]+,60.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448332,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,301.07874,[M+H]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448333,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,318.10529,[M+NH4]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448334,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,318.10529,[M+NH4]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448335,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,318.10529,[M+NH4]+,45.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448336,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,318.10529,[M+NH4]+,60.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448337,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1,318.10529,[M+NH4]+,20.0,val,Cc1nn2c(S(=O)(=O)N3CCCCC3)c(C)nc2s1
448338,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,20.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448339,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,20.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448340,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,30.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448341,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,60.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448342,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,20.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448343,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,30.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448344,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,60.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448345,Nc1nn(CC(=O)NC2CCCCC2)cc1Br,301.06585,[M+H]+,20.0,val,Nc1nn(CC(=O)NC2CCCCC2)cc1Br
448346,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,20.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448347,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,20.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448348,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,30.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448349,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,60.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448350,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,20.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448351,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,20.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448352,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1,301.06585,[M+H]+,60.0,val,CCN1CCN(C(=O)c2nn(C)cc2Br)CC1
448353,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC,359.02108,[M+H]+,20.0,val,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC
448354,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC,359.02108,[M+H]+,20.0,val,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC
448355,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC,359.02108,[M+H]+,60.0,val,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC
448356,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC,359.02108,[M+H]+,15.0,val,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC
448357,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC,359.02108,[M+H]+,20.0,val,COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC
448358,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448359,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448360,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448361,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448362,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,45.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448363,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448364,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448365,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,302.08162,[M-H]-,45.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448366,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448367,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448368,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,304.09617,[M+H]+,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448369,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,304.09617,[M+H]+,15.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448370,CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCOCC1,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448371,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448372,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448373,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,45.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448374,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448375,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448376,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,45.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448377,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448378,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,302.08162,[M-H]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448379,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,338.05829,[M+Cl]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448380,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,338.05829,[M+Cl]-,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448381,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,338.05829,[M+Cl]-,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448382,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448383,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448384,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,304.09617,[M+H]+,60.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448385,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,304.09617,[M+H]+,15.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448386,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C,304.09617,[M+H]+,20.0,val,CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)n[nH]c1C
448387,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,274.05771,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448388,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,274.05771,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448389,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,274.05771,[M-H]-,60.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448390,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,274.05771,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448391,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,274.05771,[M-H]-,45.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448392,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,258.0617,[M+H-H2O]+,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448393,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,258.0617,[M+H-H2O]+,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448394,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,258.0617,[M+H-H2O]+,60.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448395,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,258.0617,[M+H-H2O]+,30.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448396,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1,258.0617,[M+H-H2O]+,20.0,val,Cc1ccc(S(=O)(=O)NCC2(O)CCCC2)s1
448397,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,20.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448398,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,20.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448399,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,60.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448400,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,20.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448401,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,45.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448402,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,60.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448403,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,20.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448404,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1,258.08055,[M-H]-,45.0,val,O=C(NS(=O)(=O)C1CCOC1)[C@H]1C[C@@H]1C1CC1
448405,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,20.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448406,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,20.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448407,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,60.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448408,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,20.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448409,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,45.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448410,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,60.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448411,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,20.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448412,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1,258.08055,[M-H]-,45.0,val,CCC(CC)CS(=O)(=O)NC(=O)c1ccco1
448413,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO,260.0951,[M+H]+,20.0,val,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO
448414,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO,260.0951,[M+H]+,20.0,val,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO
448415,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO,260.0951,[M+H]+,60.0,val,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO
448416,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO,260.0951,[M+H]+,15.0,val,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO
448417,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO,260.0951,[M+H]+,20.0,val,C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1CO
448418,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O,258.09831,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O
448419,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O,258.09831,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O
448420,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O,258.09831,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O
448421,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O,258.09831,[M-H]-,30.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O
448422,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O,258.09831,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)O)C1C(=O)O
448423,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,298.11886,[M-H]-,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448424,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,298.11886,[M-H]-,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448425,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,298.11886,[M-H]-,60.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448426,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,298.11886,[M-H]-,15.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448427,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,298.11886,[M-H]-,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448428,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448429,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448430,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,60.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448431,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,30.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448432,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448433,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448434,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448435,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,60.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448436,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,30.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448437,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448438,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,60.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448439,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,30.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448440,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C,300.13341,[M+H]+,20.0,val,CCN(c1nc(N)c(C(=O)N=C(N)N)nc1Cl)C(C)C
448441,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,225.12447,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448442,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,225.12447,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448443,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,225.12447,[M-H]-,30.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448444,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,225.12447,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448445,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448446,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448447,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,30.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448448,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448449,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,15.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448450,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448451,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448452,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448453,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,249.12096,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448454,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,249.12096,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448455,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,249.12096,[M+Na]+,20.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448456,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,249.12096,[M+Na]+,60.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448457,O=C(O)C1CCN(C(=O)N2CCCC2)CC1,249.12096,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)N2CCCC2)CC1
448458,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,209.12846,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448459,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,209.12846,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448460,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,209.12846,[M+H-H2O]+,60.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448461,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,209.12846,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448462,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,209.12846,[M+H-H2O]+,45.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448463,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448464,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448465,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448466,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,30.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448467,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448468,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448469,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,30.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448470,O=C(O)C1CCCN(C(=O)N2CCCC2)C1,227.13902,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)N2CCCC2)C1
448471,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,289.08637,[M-H]-,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448472,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,289.08637,[M-H]-,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448473,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,289.08637,[M-H]-,60.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448474,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,289.08637,[M-H]-,15.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448475,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,289.08637,[M-H]-,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448476,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,291.10092,[M+H]+,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448477,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,291.10092,[M+H]+,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448478,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,291.10092,[M+H]+,60.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448479,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,291.10092,[M+H]+,15.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448480,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,291.10092,[M+H]+,20.0,val,C=CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
448481,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448482,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448483,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,60.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448484,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448485,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,45.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448486,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,60.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448487,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448488,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,285.10269,[M-H]-,45.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448489,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,321.07936,[M+Cl]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448490,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,321.07936,[M+Cl]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448491,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,321.07936,[M+Cl]-,60.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448492,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,321.07936,[M+Cl]-,15.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448493,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,321.07936,[M+Cl]-,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448494,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,287.11724,[M+H]+,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448495,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,287.11724,[M+H]+,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448496,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,287.11724,[M+H]+,60.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448497,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,287.11724,[M+H]+,30.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448498,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1,287.11724,[M+H]+,20.0,val,CCC(=O)N1CCC(NS(=O)(=O)c2ccnn2C)C1
448499,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,20.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448500,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,20.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448501,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,60.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448502,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,30.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448503,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,20.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448504,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,30.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448505,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,60.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448506,C[N+](C)(C)CCc1ccc(O)cc1,180.13829,[M]+,20.0,val,C[N+](C)(C)CCc1ccc(O)cc1
448507,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448508,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448509,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,60.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448510,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,30.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448511,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448512,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,60.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448513,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,30.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448514,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,336.06934,[M-H]-,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448515,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,338.08389,[M+H]+,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448516,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,338.08389,[M+H]+,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448517,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,338.08389,[M+H]+,60.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448518,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,338.08389,[M+H]+,30.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448519,Cc1noc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c1,338.08389,[M+H]+,20.0,val,Cc1cc(CS(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)on1
448520,O=C1NC(=O)/C(=C/c2cc3c(cc2)OC(F)(F)O3)S1,283.98346,[M-H]-,20.0,val,O=C1NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1
448521,O=C1NC(=O)/C(=C/c2cc3c(cc2)OC(F)(F)O3)S1,283.98346,[M-H]-,20.0,val,O=C1NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1
448522,O=C1NC(=O)/C(=C/c2cc3c(cc2)OC(F)(F)O3)S1,283.98346,[M-H]-,60.0,val,O=C1NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1
448523,O=C1NC(=O)/C(=C/c2cc3c(cc2)OC(F)(F)O3)S1,283.98346,[M-H]-,30.0,val,O=C1NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1
448524,O=C1NC(=O)/C(=C/c2cc3c(cc2)OC(F)(F)O3)S1,283.98346,[M-H]-,20.0,val,O=C1NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1
448525,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,20.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448526,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,60.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448527,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,30.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448528,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,20.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448529,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,20.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448530,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,30.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448531,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O,305.93422,[M-H]-,60.0,val,N#Cc1c(-c2ccc(Br)cc2)[nH]c(=S)[nH]c1=O
448532,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448533,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448534,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,60.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448535,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,30.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448536,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448537,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,30.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448538,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448539,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,319.98777,[M-H]-,60.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448540,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,355.96445,[M+Cl]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448541,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,355.96445,[M+Cl]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448542,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,355.96445,[M+Cl]-,60.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448543,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,355.96445,[M+Cl]-,15.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448544,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl,355.96445,[M+Cl]-,20.0,val,Cc1nnsc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
448545,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448546,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448547,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,60.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448548,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,15.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448549,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448550,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,60.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448551,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,15.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448552,O=C(O)c1cnc(-c2ccccc2Cl)nc1,233.01233,[M-H]-,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448553,O=C(O)c1ncnc(-c2ccccc2Cl)c1,233.01233,[M-H]-,15.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448554,O=C(O)c1ncnc(-c2ccccc2Cl)c1,233.01233,[M-H]-,15.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448555,O=C(O)c1ncnc(-c2ccccc2Cl)c1,233.01233,[M-H]-,20.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448556,O=C(O)c1ncnc(-c2ccccc2Cl)c1,233.01233,[M-H]-,15.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448557,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,20.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448558,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,20.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448559,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,60.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448560,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,30.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448561,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,20.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448562,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,60.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448563,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,30.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448564,O=C(O)c1ncnc(-c2ccccc2Cl)c1,235.02688,[M+H]+,20.0,val,O=C(O)c1cc(-c2ccccc2Cl)ncn1
448565,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448566,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448567,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,60.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448568,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448569,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,45.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448570,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,60.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448571,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,20.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448572,O=C(O)c1cnc(-c2ccccc2Cl)nc1,235.02688,[M+H]+,45.0,val,O=C(O)c1cnc(-c2ccccc2Cl)nc1
448573,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448574,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448575,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,60.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448576,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,15.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448577,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448578,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,60.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448579,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,15.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448580,O=C(O)c1nn(-c2ccccc2F)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccccc2F)n1
448581,O=C(O)c1nn(-c2ccc(F)cc2)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccc(F)cc2)n1
448582,O=C(O)c1nn(-c2ccc(F)cc2)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccc(F)cc2)n1
448583,O=C(O)c1nn(-c2ccc(F)cc2)c(=O)cc1,233.03679,[M-H]-,60.0,val,O=C(O)c1ccc(=O)n(-c2ccc(F)cc2)n1
448584,O=C(O)c1nn(-c2ccc(F)cc2)c(=O)cc1,233.03679,[M-H]-,15.0,val,O=C(O)c1ccc(=O)n(-c2ccc(F)cc2)n1
448585,O=C(O)c1nn(-c2ccc(F)cc2)c(=O)cc1,233.03679,[M-H]-,20.0,val,O=C(O)c1ccc(=O)n(-c2ccc(F)cc2)n1
448586,C/C(O)=C(\C#N)C(=O)Nc1c(Br)ccc(Br)c1,356.88798,[M-H]-,20.0,val,C/C(O)=C(\C#N)C(=O)Nc1cc(Br)ccc1Br
448587,C/C(O)=C(\C#N)C(=O)Nc1c(Br)ccc(Br)c1,356.88798,[M-H]-,20.0,val,C/C(O)=C(\C#N)C(=O)Nc1cc(Br)ccc1Br
448588,C/C(O)=C(\C#N)C(=O)Nc1c(Br)ccc(Br)c1,356.88798,[M-H]-,60.0,val,C/C(O)=C(\C#N)C(=O)Nc1cc(Br)ccc1Br
448589,C/C(O)=C(\C#N)C(=O)Nc1c(Br)ccc(Br)c1,356.88798,[M-H]-,30.0,val,C/C(O)=C(\C#N)C(=O)Nc1cc(Br)ccc1Br
448590,C/C(O)=C(\C#N)C(=O)Nc1c(Br)ccc(Br)c1,356.88798,[M-H]-,20.0,val,C/C(O)=C(\C#N)C(=O)Nc1cc(Br)ccc1Br
448591,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,314.98686,[M+H]+,20.0,val,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12
448592,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,314.98686,[M+H]+,20.0,val,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12
448593,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,314.98686,[M+H]+,60.0,val,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12
448594,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,314.98686,[M+H]+,30.0,val,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12
448595,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,314.98686,[M+H]+,20.0,val,Cc1nnc2sc(COc3ccc(Cl)cc3Cl)nn12
448596,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448597,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448598,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,60.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448599,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,30.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448600,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448601,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,60.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448602,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,30.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448603,O=C(O)Cc1csc(-c2ccccc2Cl)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2ccccc2Cl)n1
448604,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448605,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448606,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,60.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448607,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,30.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448608,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448609,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,60.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448610,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,30.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448611,O=C(O)Cc1csc(-c2cc(Cl)ccc2)n1,254.0037,[M+H]+,20.0,val,O=C(O)Cc1csc(-c2cccc(Cl)c2)n1
448612,Cc1c(C(=O)O)c(-c2cc(Cl)ccc2)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2cccc(Cl)c2)c1C(=O)O
448613,Cc1c(C(=O)O)c(-c2cc(Cl)ccc2)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2cccc(Cl)c2)c1C(=O)O
448614,Cc1c(C(=O)O)c(-c2cc(Cl)ccc2)no1,236.012,[M-H]-,60.0,val,Cc1onc(-c2cccc(Cl)c2)c1C(=O)O
448615,Cc1c(C(=O)O)c(-c2cc(Cl)ccc2)no1,236.012,[M-H]-,15.0,val,Cc1onc(-c2cccc(Cl)c2)c1C(=O)O
448616,Cc1c(C(=O)O)c(-c2cc(Cl)ccc2)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2cccc(Cl)c2)c1C(=O)O
448617,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,236.012,[M-H]-,15.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448618,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,236.012,[M-H]-,15.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448619,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,236.012,[M-H]-,60.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448620,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,236.012,[M-H]-,20.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448621,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,236.012,[M-H]-,15.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448622,Cc1c(C(=O)O)c(-c2ccccc2Cl)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2ccccc2Cl)c1C(=O)O
448623,Cc1c(C(=O)O)c(-c2ccccc2Cl)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2ccccc2Cl)c1C(=O)O
448624,Cc1c(C(=O)O)c(-c2ccccc2Cl)no1,236.012,[M-H]-,60.0,val,Cc1onc(-c2ccccc2Cl)c1C(=O)O
448625,Cc1c(C(=O)O)c(-c2ccccc2Cl)no1,236.012,[M-H]-,15.0,val,Cc1onc(-c2ccccc2Cl)c1C(=O)O
448626,Cc1c(C(=O)O)c(-c2ccccc2Cl)no1,236.012,[M-H]-,20.0,val,Cc1onc(-c2ccccc2Cl)c1C(=O)O
448627,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,20.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448628,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,20.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448629,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,60.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448630,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,20.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448631,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,45.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448632,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,60.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448633,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,20.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448634,Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2)o1,238.02655,[M+H]+,45.0,val,Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)O
448635,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,20.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448636,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,20.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448637,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,30.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448638,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,60.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448639,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,15.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448640,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,20.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448641,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,60.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448642,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1,238.02655,[M+H]+,20.0,val,O=C(O)Cc1coc(-c2ccc(Cl)cc2)n1
448643,Cn1cc(C(=O)O)c(=O)c2c1ccc(Cl)c2,238.02655,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21
448644,Cn1cc(C(=O)O)c(=O)c2c1ccc(Cl)c2,238.02655,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21
448645,Cn1cc(C(=O)O)c(=O)c2c1ccc(Cl)c2,238.02655,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21
448646,Cn1cc(C(=O)O)c(=O)c2c1ccc(Cl)c2,238.02655,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21
448647,Cn1cc(C(=O)O)c(=O)c2c1ccc(Cl)c2,238.02655,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21
448648,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448649,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448650,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,60.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448651,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448652,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,45.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448653,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,60.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448654,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448655,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,366.95607,[M-H]-,45.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448656,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,368.97062,[M+H]+,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448657,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,368.97062,[M+H]+,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448658,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,368.97062,[M+H]+,60.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448659,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,368.97062,[M+H]+,20.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448660,Cc1c(-n2[nH]c(C(F)(F)F)cc2=O)ccc(I)c1,368.97062,[M+H]+,45.0,val,Cc1cc(I)ccc1-n1[nH]c(C(F)(F)F)cc1=O
448661,O=C(O)c1cc(-c2ccccc2)nnc1,199.0513,[M-H]-,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448662,O=C(O)c1cc(-c2ccccc2)nnc1,199.0513,[M-H]-,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448663,O=C(O)c1cc(-c2ccccc2)nnc1,199.0513,[M-H]-,60.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448664,O=C(O)c1cc(-c2ccccc2)nnc1,199.0513,[M-H]-,15.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448665,O=C(O)c1cc(-c2ccccc2)nnc1,199.0513,[M-H]-,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448666,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448667,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448668,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,60.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448669,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448670,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,45.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448671,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,60.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448672,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,20.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448673,O=C(O)c1cc(-c2ccccc2)nnc1,201.06585,[M+H]+,45.0,val,O=C(O)c1cnnc(-c2ccccc2)c1
448674,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448675,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448676,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,60.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448677,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,30.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448678,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448679,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,45.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448680,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,60.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448681,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1,363.88738,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Br)s1
448682,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448683,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448684,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,60.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448685,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,15.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448686,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448687,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,60.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448688,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,15.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448689,CS(=O)(=O)Nc1c(Oc2c(F)cc(F)cc2)ccs1,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448690,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448691,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448692,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,60.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448693,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,30.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448694,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448695,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,30.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448696,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,20.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448697,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F,303.99192,[M-H]-,60.0,val,CS(=O)(=O)Nc1sccc1Oc1ccc(F)cc1F
448698,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,235.05244,[M-H]-,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448699,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,235.05244,[M-H]-,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448700,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,235.05244,[M-H]-,60.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448701,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,235.05244,[M-H]-,15.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448702,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,235.05244,[M-H]-,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448703,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448704,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448705,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,30.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448706,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,60.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448707,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,15.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448708,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448709,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,60.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448710,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1,237.067,[M+H]+,20.0,val,O=C(O)Cc1cc(=O)n(-c2ccc(F)cc2)[nH]1
448711,Cc1c(C(=O)O)cnc2ccccc12,186.05605,[M-H]-,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448712,Cc1c(C(=O)O)cnc2ccccc12,186.05605,[M-H]-,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448713,Cc1c(C(=O)O)cnc2ccccc12,186.05605,[M-H]-,15.0,val,Cc1c(C(=O)O)cnc2ccccc12
448714,Cc1c(C(=O)O)cnc2ccccc12,186.05605,[M-H]-,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448715,O=C(O)c1ccc(-c2ccccc2)[nH]1,186.05605,[M-H]-,20.0,val,O=C(O)c1ccc(-c2ccccc2)[nH]1
448716,O=C(O)c1ccc(-c2ccccc2)[nH]1,186.05605,[M-H]-,20.0,val,O=C(O)c1ccc(-c2ccccc2)[nH]1
448717,O=C(O)c1ccc(-c2ccccc2)[nH]1,186.05605,[M-H]-,60.0,val,O=C(O)c1ccc(-c2ccccc2)[nH]1
448718,O=C(O)c1ccc(-c2ccccc2)[nH]1,186.05605,[M-H]-,30.0,val,O=C(O)c1ccc(-c2ccccc2)[nH]1
448719,O=C(O)c1ccc(-c2ccccc2)[nH]1,186.05605,[M-H]-,20.0,val,O=C(O)c1ccc(-c2ccccc2)[nH]1
448720,Cc1nc2ccccc2c(C(=O)O)c1,186.05605,[M-H]-,15.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448721,Cc1nc2ccccc2c(C(=O)O)c1,186.05605,[M-H]-,15.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448722,Cc1nc2ccccc2c(C(=O)O)c1,186.05605,[M-H]-,20.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448723,Cc1nc2ccccc2c(C(=O)O)c1,186.05605,[M-H]-,15.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448724,Cc1nc2ccccc2c(C(=O)O)c1,186.05605,[M-H]-,15.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448725,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448726,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448727,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,30.0,val,Cc1nc2ccccc2cc1C(=O)O
448728,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,15.0,val,Cc1nc2ccccc2cc1C(=O)O
448729,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448730,Cc1nc2ccccc2cc1C(=O)O,186.05605,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448731,O=C(O)c1c(-c2ccccc2)cc[nH]1,186.05605,[M-H]-,15.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448732,O=C(O)c1c(-c2ccccc2)cc[nH]1,186.05605,[M-H]-,15.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448733,O=C(O)c1c(-c2ccccc2)cc[nH]1,186.05605,[M-H]-,20.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448734,O=C(O)c1c(-c2ccccc2)cc[nH]1,186.05605,[M-H]-,60.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448735,O=C(O)c1c(-c2ccccc2)cc[nH]1,186.05605,[M-H]-,15.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448736,Cc1c(C(=O)O)cnc2ccccc12,170.06005,[M+H-H2O]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448737,Cc1c(C(=O)O)cnc2ccccc12,170.06005,[M+H-H2O]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448738,Cc1c(C(=O)O)cnc2ccccc12,170.06005,[M+H-H2O]+,60.0,val,Cc1c(C(=O)O)cnc2ccccc12
448739,Cc1c(C(=O)O)cnc2ccccc12,170.06005,[M+H-H2O]+,30.0,val,Cc1c(C(=O)O)cnc2ccccc12
448740,Cc1c(C(=O)O)cnc2ccccc12,170.06005,[M+H-H2O]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448741,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448742,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448743,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,60.0,val,Cc1c(C(=O)O)cnc2ccccc12
448744,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448745,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,45.0,val,Cc1c(C(=O)O)cnc2ccccc12
448746,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,60.0,val,Cc1c(C(=O)O)cnc2ccccc12
448747,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1c(C(=O)O)cnc2ccccc12
448748,Cc1c(C(=O)O)cnc2ccccc12,188.07061,[M+H]+,45.0,val,Cc1c(C(=O)O)cnc2ccccc12
448749,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448750,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448751,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,60.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448752,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448753,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,45.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448754,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,60.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448755,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448756,Cc1ccc2cccc(C(=O)O)c2n1,170.06005,[M+H-H2O]+,45.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448757,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448758,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448759,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,30.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448760,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,60.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448761,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448762,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,45.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448763,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,60.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448764,Cc1ccc2cccc(C(=O)O)c2n1,188.07061,[M+H]+,20.0,val,Cc1ccc2cccc(C(=O)O)c2n1
448765,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448766,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448767,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,60.0,val,Cc1nc2ccccc2cc1C(=O)O
448768,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448769,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,45.0,val,Cc1nc2ccccc2cc1C(=O)O
448770,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,60.0,val,Cc1nc2ccccc2cc1C(=O)O
448771,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,20.0,val,Cc1nc2ccccc2cc1C(=O)O
448772,Cc1nc2ccccc2cc1C(=O)O,188.07061,[M+H]+,45.0,val,Cc1nc2ccccc2cc1C(=O)O
448773,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cnc2ccccc2c1
448774,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cnc2ccccc2c1
448775,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cnc2ccccc2c1
448776,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,30.0,val,O=C(O)Cc1cnc2ccccc2c1
448777,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cnc2ccccc2c1
448778,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,45.0,val,O=C(O)Cc1cnc2ccccc2c1
448779,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cnc2ccccc2c1
448780,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cnc2ccccc2c1
448781,O=C(O)Cc1cc2ccccc2nc1,188.07061,[M+H]+,45.0,val,O=C(O)Cc1cnc2ccccc2c1
448782,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cncc2ccccc12
448783,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cncc2ccccc12
448784,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cncc2ccccc12
448785,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cncc2ccccc12
448786,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,45.0,val,O=C(O)Cc1cncc2ccccc12
448787,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cncc2ccccc12
448788,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cncc2ccccc12
448789,O=C(O)Cc1cncc2ccccc12,188.07061,[M+H]+,45.0,val,O=C(O)Cc1cncc2ccccc12
448790,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,20.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448791,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,20.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448792,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,60.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448793,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,20.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448794,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,60.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448795,Cc1c2cc(C(=O)O)ccc2ncc1,188.07061,[M+H]+,20.0,val,Cc1ccnc2ccc(C(=O)O)cc12
448796,O=C(O)Cc1ccc2cnccc2c1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1ccc2cnccc2c1
448797,O=C(O)Cc1ccc2cnccc2c1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1ccc2cnccc2c1
448798,O=C(O)Cc1ccc2cnccc2c1,188.07061,[M+H]+,60.0,val,O=C(O)Cc1ccc2cnccc2c1
448799,O=C(O)Cc1ccc2cnccc2c1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1ccc2cnccc2c1
448800,O=C(O)Cc1ccc2cnccc2c1,188.07061,[M+H]+,45.0,val,O=C(O)Cc1ccc2cnccc2c1
448801,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)nc2ccccc12
448802,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)nc2ccccc12
448803,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,60.0,val,Cc1cc(C(=O)O)nc2ccccc12
448804,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,30.0,val,Cc1cc(C(=O)O)nc2ccccc12
448805,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)nc2ccccc12
448806,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,60.0,val,Cc1cc(C(=O)O)nc2ccccc12
448807,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,30.0,val,Cc1cc(C(=O)O)nc2ccccc12
448808,Cc1cc(C(=O)O)nc2ccccc12,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)nc2ccccc12
448809,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448810,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448811,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,60.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448812,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448813,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,60.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448814,Cc1nc2ccccc2c(C(=O)O)c1,188.07061,[M+H]+,20.0,val,Cc1cc(C(=O)O)c2ccccc2n1
448815,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,20.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448816,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,20.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448817,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,60.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448818,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,20.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448819,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,60.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448820,Cc1cc2c(cn1)c(C(=O)O)ccc2,188.07061,[M+H]+,20.0,val,Cc1cc2cccc(C(=O)O)c2cn1
448821,O=C(O)c1c(-c2ccccc2)cc[nH]1,188.07061,[M+H]+,20.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448822,O=C(O)c1c(-c2ccccc2)cc[nH]1,188.07061,[M+H]+,20.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448823,O=C(O)c1c(-c2ccccc2)cc[nH]1,188.07061,[M+H]+,60.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448824,O=C(O)c1c(-c2ccccc2)cc[nH]1,188.07061,[M+H]+,20.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448825,O=C(O)c1c(-c2ccccc2)cc[nH]1,188.07061,[M+H]+,60.0,val,O=C(O)c1[nH]ccc1-c1ccccc1
448826,O=C(O)Cc1c2ncccc2ccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448827,O=C(O)Cc1c2ncccc2ccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448828,O=C(O)Cc1c2ncccc2ccc1,170.06005,[M+H-H2O]+,60.0,val,O=C(O)Cc1cccc2cccnc12
448829,O=C(O)Cc1c2ncccc2ccc1,170.06005,[M+H-H2O]+,30.0,val,O=C(O)Cc1cccc2cccnc12
448830,O=C(O)Cc1c2ncccc2ccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448831,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448832,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448833,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,30.0,val,O=C(O)Cc1cccc2cccnc12
448834,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cccc2cccnc12
448835,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,15.0,val,O=C(O)Cc1cccc2cccnc12
448836,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448837,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,60.0,val,O=C(O)Cc1cccc2cccnc12
448838,O=C(O)Cc1c2ncccc2ccc1,188.07061,[M+H]+,20.0,val,O=C(O)Cc1cccc2cccnc12
448839,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448840,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448841,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,30.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448842,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,60.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448843,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,15.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448844,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448845,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,60.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448846,Cc1cc2c(cc1)nc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)O)ccc2c1
448847,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,20.0,val,Cc1ccc(C(=O)O)c2cccnc12
448848,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,20.0,val,Cc1ccc(C(=O)O)c2cccnc12
448849,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,60.0,val,Cc1ccc(C(=O)O)c2cccnc12
448850,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,15.0,val,Cc1ccc(C(=O)O)c2cccnc12
448851,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,20.0,val,Cc1ccc(C(=O)O)c2cccnc12
448852,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,60.0,val,Cc1ccc(C(=O)O)c2cccnc12
448853,Cc1c2ncccc2c(C(=O)O)cc1,188.07061,[M+H]+,20.0,val,Cc1ccc(C(=O)O)c2cccnc12
448854,O=C(O)c1c[nH]cc1-c1ccccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448855,O=C(O)c1c[nH]cc1-c1ccccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448856,O=C(O)c1c[nH]cc1-c1ccccc1,170.06005,[M+H-H2O]+,60.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448857,O=C(O)c1c[nH]cc1-c1ccccc1,170.06005,[M+H-H2O]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448858,O=C(O)c1c[nH]cc1-c1ccccc1,170.06005,[M+H-H2O]+,45.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448859,O=C(O)c1c[nH]cc1-c1ccccc1,188.07061,[M+H]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448860,O=C(O)c1c[nH]cc1-c1ccccc1,188.07061,[M+H]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448861,O=C(O)c1c[nH]cc1-c1ccccc1,188.07061,[M+H]+,60.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448862,O=C(O)c1c[nH]cc1-c1ccccc1,188.07061,[M+H]+,15.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448863,O=C(O)c1c[nH]cc1-c1ccccc1,188.07061,[M+H]+,20.0,val,O=C(O)c1c[nH]cc1-c1ccccc1
448864,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448865,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448866,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,60.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448867,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448868,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,60.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448869,Cc1nc2c(cc1)cc(C(=O)O)cc2,188.07061,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)O)ccc2n1
448870,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448871,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448872,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,60.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448873,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,30.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448874,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448875,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448876,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448877,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,60.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448878,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,30.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448879,O=C(O)/C=C/c1c[nH]c2ccccc12,186.05605,[M-H]-,20.0,val,O=C(O)/C=C/c1c[nH]c2ccccc12
448880,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448881,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448882,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,30.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448883,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,60.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448884,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448885,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,45.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448886,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448887,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,314.97673,[M-H]-,60.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448888,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448889,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448890,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,60.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448891,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,15.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448892,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448893,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448894,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,15.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448895,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,314.97673,[M-H]-,60.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448896,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,350.95341,[M+Cl]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448897,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,350.95341,[M+Cl]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448898,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,350.95341,[M+Cl]-,60.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448899,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,350.95341,[M+Cl]-,15.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448900,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1,350.95341,[M+Cl]-,20.0,val,O=c1cc(CSCc2ccc(Cl)c(Cl)c2)[nH]c(=O)[nH]1
448901,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1
448902,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1
448903,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,60.0,val,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1
448904,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,15.0,val,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1
448905,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2c(Cl)cccc2Cl)[nH]c(=O)[nH]1
448906,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1
448907,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1
448908,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,60.0,val,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1
448909,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,15.0,val,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1
448910,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1,314.97673,[M-H]-,20.0,val,O=c1cc(CSCc2ccc(Cl)cc2Cl)[nH]c(=O)[nH]1
448911,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448912,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448913,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,45.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448914,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,60.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448915,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448916,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448917,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,45.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448918,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,314.97673,[M-H]-,60.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448919,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,350.95341,[M+Cl]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448920,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,350.95341,[M+Cl]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448921,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,350.95341,[M+Cl]-,60.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448922,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,350.95341,[M+Cl]-,30.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448923,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1,350.95341,[M+Cl]-,20.0,val,O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(Cl)nc1
448924,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448925,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448926,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,45.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448927,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,60.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448928,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448929,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,60.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448930,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl,314.97673,[M-H]-,20.0,val,Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1Cl
448931,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,316.99128,[M+H]+,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448932,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,316.99128,[M+H]+,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448933,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,316.99128,[M+H]+,45.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448934,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,316.99128,[M+H]+,60.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448935,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl,316.99128,[M+H]+,20.0,val,O=S(=O)(NCc1ccncc1)c1cc(Cl)ccc1Cl
448936,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1,348.96335,[M+H]+,20.0,val,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1
448937,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1,348.96335,[M+H]+,20.0,val,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1
448938,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1,348.96335,[M+H]+,60.0,val,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1
448939,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1,348.96335,[M+H]+,20.0,val,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1
448940,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1,348.96335,[M+H]+,60.0,val,Cc1cc(Cl)c(Sc2ccncc2S(N)(=O)=O)c(Cl)c1
448941,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,300.06015,[M-H]-,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448942,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,300.06015,[M-H]-,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448943,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,300.06015,[M-H]-,60.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448944,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,300.06015,[M-H]-,30.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448945,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,300.06015,[M-H]-,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448946,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,302.0747,[M+H]+,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448947,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,302.0747,[M+H]+,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448948,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,302.0747,[M+H]+,60.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448949,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,302.0747,[M+H]+,20.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448950,C[C@@H](NC(=O)c1cc2nc(C(F)(F)F)cn2cc1)C(=O)O,302.0747,[M+H]+,45.0,val,C[C@@H](NC(=O)c1ccn2cc(C(F)(F)F)nc2c1)C(=O)O
448951,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1,312.02712,[M+H]+,20.0,val,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1
448952,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1,312.02712,[M+H]+,20.0,val,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1
448953,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1,312.02712,[M+H]+,60.0,val,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1
448954,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1,312.02712,[M+H]+,30.0,val,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1
448955,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1,312.02712,[M+H]+,20.0,val,O=C1OCCN1c1nnc(SCc2ccc(F)cc2)s1
448956,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,253.08433,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448957,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,253.08433,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448958,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,253.08433,[M-H]-,60.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448959,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,253.08433,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448960,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,253.08433,[M-H]-,45.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448961,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,289.06101,[M+Cl]-,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448962,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,289.06101,[M+Cl]-,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448963,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,289.06101,[M+Cl]-,60.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448964,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,255.09888,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448965,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,255.09888,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448966,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,255.09888,[M+H]+,60.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448967,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,255.09888,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448968,Cc1nn2cc(NC(=O)c3cncnc3)ccc2n1,255.09888,[M+H]+,45.0,val,Cc1nc2ccc(NC(=O)c3cncnc3)cn2n1
448969,Nc1nc2ncc(-c3cc(O)ccc3)nc2c(N)n1,255.09888,[M+H]+,20.0,val,Nc1nc(N)c2nc(-c3cccc(O)c3)cnc2n1
448970,Nc1nc2ncc(-c3cc(O)ccc3)nc2c(N)n1,255.09888,[M+H]+,20.0,val,Nc1nc(N)c2nc(-c3cccc(O)c3)cnc2n1
448971,Nc1nc2ncc(-c3cc(O)ccc3)nc2c(N)n1,255.09888,[M+H]+,60.0,val,Nc1nc(N)c2nc(-c3cccc(O)c3)cnc2n1
448972,Nc1nc2ncc(-c3cc(O)ccc3)nc2c(N)n1,255.09888,[M+H]+,20.0,val,Nc1nc(N)c2nc(-c3cccc(O)c3)cnc2n1
448973,Nc1nc2ncc(-c3cc(O)ccc3)nc2c(N)n1,255.09888,[M+H]+,60.0,val,Nc1nc(N)c2nc(-c3cccc(O)c3)cnc2n1
448974,CCOC(=O)c1cc2ccccc2oc1=O,219.06518,[M+H]+,15.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448975,CCOC(=O)c1cc2ccccc2oc1=O,219.06518,[M+H]+,15.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448976,CCOC(=O)c1cc2ccccc2oc1=O,219.06518,[M+H]+,20.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448977,CCOC(=O)c1cc2ccccc2oc1=O,219.06518,[M+H]+,60.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448978,CCOC(=O)c1cc2ccccc2oc1=O,219.06518,[M+H]+,15.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448979,CCOC(=O)c1cc2ccccc2oc1=O,241.04713,[M+Na]+,20.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448980,CCOC(=O)c1cc2ccccc2oc1=O,241.04713,[M+Na]+,20.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448981,CCOC(=O)c1cc2ccccc2oc1=O,241.04713,[M+Na]+,60.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448982,CCOC(=O)c1cc2ccccc2oc1=O,241.04713,[M+Na]+,30.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448983,CCOC(=O)c1cc2ccccc2oc1=O,241.04713,[M+Na]+,20.0,val,CCOC(=O)c1cc2ccccc2oc1=O
448984,CCOC(=O)c1cnc2ccc(OC)nc2c1Br,311.00258,[M+H]+,20.0,val,CCOC(=O)c1cnc2ccc(OC)nc2c1Br
448985,CCOC(=O)c1cnc2ccc(OC)nc2c1Br,311.00258,[M+H]+,20.0,val,CCOC(=O)c1cnc2ccc(OC)nc2c1Br
448986,CCOC(=O)c1cnc2ccc(OC)nc2c1Br,311.00258,[M+H]+,60.0,val,CCOC(=O)c1cnc2ccc(OC)nc2c1Br
448987,CCOC(=O)c1cnc2ccc(OC)nc2c1Br,311.00258,[M+H]+,30.0,val,CCOC(=O)c1cnc2ccc(OC)nc2c1Br
448988,CCOC(=O)c1cnc2ccc(OC)nc2c1Br,311.00258,[M+H]+,20.0,val,CCOC(=O)c1cnc2ccc(OC)nc2c1Br
448989,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448990,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448991,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,60.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448992,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,15.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448993,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448994,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,15.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448995,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448996,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,308.98803,[M-H]-,60.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
448997,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,20.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
448998,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,20.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
448999,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,60.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449000,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,15.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449001,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,20.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449002,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,20.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449003,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,15.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449004,NNC(=O)c1ccc(COc2ccccc2Br)o1,311.00258,[M+H]+,60.0,val,NNC(=O)c1ccc(COc2ccccc2Br)o1
449005,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,311.00258,[M+H]+,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
449006,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,311.00258,[M+H]+,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
449007,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,311.00258,[M+H]+,45.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
449008,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,311.00258,[M+H]+,60.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
449009,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O,311.00258,[M+H]+,20.0,val,CC(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O
449010,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1,311.00258,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1
449011,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1,311.00258,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1
449012,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1,311.00258,[M+H]+,60.0,val,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1
449013,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1,311.00258,[M+H]+,30.0,val,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1
449014,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1,311.00258,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C)o1
449015,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,340.9601,[M-H]-,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449016,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,340.9601,[M-H]-,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449017,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,340.9601,[M-H]-,60.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449018,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,340.9601,[M-H]-,15.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449019,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,340.9601,[M-H]-,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449020,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449021,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449022,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449023,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,30.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449024,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449025,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449026,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449027,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,340.9601,[M-H]-,30.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449028,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449029,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449030,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449031,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,15.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449032,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,15.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449033,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,376.93678,[M+Cl]-,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449034,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,386.96558,[M+FA]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449035,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,386.96558,[M+FA]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449036,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,386.96558,[M+FA]-,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449037,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,386.96558,[M+FA]-,15.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449038,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,386.96558,[M+FA]-,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449039,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,342.97465,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449040,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,342.97465,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449041,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,342.97465,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449042,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,342.97465,[M+H]+,60.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449043,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1,342.97465,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cccs1)c1ccc(Br)o1
449044,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,342.97465,[M+H]+,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449045,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,342.97465,[M+H]+,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449046,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,342.97465,[M+H]+,45.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449047,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,342.97465,[M+H]+,60.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449048,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br,342.97465,[M+H]+,20.0,val,O=C(Nc1nccs1)C1C2CC3C(OC(=O)C31)C2Br
449049,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1,342.97465,[M+H]+,15.0,val,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1
449050,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1,342.97465,[M+H]+,15.0,val,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1
449051,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1,342.97465,[M+H]+,20.0,val,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1
449052,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1,342.97465,[M+H]+,60.0,val,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1
449053,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1,342.97465,[M+H]+,15.0,val,O=C(c1ccc(Br)o1)N1CCC(Oc2nccs2)C1
449054,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1,316.00726,[M+H]+,30.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1
449055,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1,316.00726,[M+H]+,30.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1
449056,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1,316.00726,[M+H]+,20.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1
449057,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1,316.00726,[M+H]+,60.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1
449058,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1,316.00726,[M+H]+,30.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)cc(Cl)c1
449059,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,20.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449060,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,20.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449061,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,60.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449062,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,30.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449063,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,20.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449064,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,60.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449065,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,30.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449066,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl,316.00726,[M+H]+,20.0,val,Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1Cl
449067,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449068,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449069,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,309.02185,[M-H]-,60.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449070,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449071,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,309.02185,[M-H]-,45.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449072,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449073,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449074,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,311.0364,[M+H]+,60.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449075,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,311.0364,[M+H]+,15.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449076,CSc1nc(=O)c(-c2c(NC(C)=O)ccc(Cl)c2)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449077,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449078,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449079,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,45.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449080,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,60.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449081,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449082,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449083,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,45.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449084,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,309.02185,[M-H]-,60.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449085,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449086,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449087,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,311.0364,[M+H]+,60.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449088,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,311.0364,[M+H]+,15.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449089,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1,311.0364,[M+H]+,20.0,val,CSc1nc(=O)c(-c2cc(Cl)ccc2NC(C)=O)n[nH]1
449090,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449091,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449092,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449093,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,30.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449094,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449095,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449096,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,30.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449097,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,233.07318,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449098,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449099,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449100,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449101,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449102,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,45.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449103,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449104,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449105,Cc1nn(-c2c(F)cc(C(=O)O)cc2)c(C)c1,235.08773,[M+H]+,45.0,val,Cc1cc(C)n(-c2ccc(C(=O)O)cc2F)n1
449106,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,20.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449107,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,20.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449108,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,60.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449109,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,20.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449110,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,45.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449111,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,60.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449112,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,20.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449113,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O,235.08773,[M+H]+,45.0,val,Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)O
449114,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449115,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449116,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,60.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449117,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,30.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449118,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449119,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,60.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449120,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,30.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449121,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,265.04525,[M-H]-,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449122,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449123,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449124,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,60.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449125,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,30.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449126,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449127,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,60.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449128,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,30.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449129,O=S(=O)(Cc1ccc(F)cc1)Nc1cnccc1,267.0598,[M+H]+,20.0,val,O=S(=O)(Cc1ccc(F)cc1)Nc1cccnc1
449130,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1,280.02852,[M-H]-,20.0,val,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1
449131,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1,280.02852,[M-H]-,20.0,val,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1
449132,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1,280.02852,[M-H]-,60.0,val,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1
449133,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1,280.02852,[M-H]-,15.0,val,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1
449134,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1,280.02852,[M-H]-,20.0,val,O=C(O)C1CCN1S(=O)(=O)c1cc2ccccc2o1
449135,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,20.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449136,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,20.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449137,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,45.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449138,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,60.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449139,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,20.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449140,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,60.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449141,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,45.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449142,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1,327.00066,[M+H]+,20.0,val,Clc1cnccc1N1CC(Cn2cc(Br)cn2)C1
449143,CCC(=O)NCc1cn(-c2c(Cl)cc(Br)cc2)nn1,342.99558,[M+H]+,20.0,val,CCC(=O)NCc1cn(-c2ccc(Br)cc2Cl)nn1
449144,CCC(=O)NCc1cn(-c2c(Cl)cc(Br)cc2)nn1,342.99558,[M+H]+,20.0,val,CCC(=O)NCc1cn(-c2ccc(Br)cc2Cl)nn1
449145,CCC(=O)NCc1cn(-c2c(Cl)cc(Br)cc2)nn1,342.99558,[M+H]+,60.0,val,CCC(=O)NCc1cn(-c2ccc(Br)cc2Cl)nn1
449146,CCC(=O)NCc1cn(-c2c(Cl)cc(Br)cc2)nn1,342.99558,[M+H]+,30.0,val,CCC(=O)NCc1cn(-c2ccc(Br)cc2Cl)nn1
449147,CCC(=O)NCc1cn(-c2c(Cl)cc(Br)cc2)nn1,342.99558,[M+H]+,20.0,val,CCC(=O)NCc1cn(-c2ccc(Br)cc2Cl)nn1
449148,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449149,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449150,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,60.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449151,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,15.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449152,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449153,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,60.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449154,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,15.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449155,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,339.97608,[M-H]-,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449156,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,341.99064,[M+H]+,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449157,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,341.99064,[M+H]+,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449158,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,341.99064,[M+H]+,60.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449159,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,341.99064,[M+H]+,30.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449160,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1,341.99064,[M+H]+,20.0,val,CC(=O)NC1=NN(C(C)=O)C(c2ccc(Br)cc2)S1
449161,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449162,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449163,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449164,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,30.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449165,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449166,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449167,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,30.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449168,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,339.97608,[M-H]-,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449169,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449170,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449171,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449172,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,15.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449173,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449174,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449175,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449176,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,375.95276,[M+Cl]-,15.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449177,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,385.98156,[M+FA]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449178,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,385.98156,[M+FA]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449179,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,385.98156,[M+FA]-,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449180,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,385.98156,[M+FA]-,15.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449181,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,385.98156,[M+FA]-,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449182,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,341.99064,[M+H]+,30.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449183,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,341.99064,[M+H]+,30.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449184,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,341.99064,[M+H]+,20.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449185,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,341.99064,[M+H]+,60.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449186,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1,341.99064,[M+H]+,30.0,val,CCc1nnc(SCC(=O)Nc2cccc(Br)c2)o1
449187,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12,322.0298,[M+H]+,20.0,val,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12
449188,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12,322.0298,[M+H]+,20.0,val,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12
449189,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12,322.0298,[M+H]+,60.0,val,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12
449190,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12,322.0298,[M+H]+,20.0,val,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12
449191,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12,322.0298,[M+H]+,45.0,val,CCC(CC#N)NC(=O)c1nnc2ccc(Br)cn12
449192,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,320.01525,[M-H]-,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449193,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,320.01525,[M-H]-,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449194,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,320.01525,[M-H]-,60.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449195,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,320.01525,[M-H]-,30.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449196,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,320.01525,[M-H]-,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449197,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,322.0298,[M+H]+,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449198,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,322.0298,[M+H]+,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449199,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,322.0298,[M+H]+,45.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449200,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,322.0298,[M+H]+,60.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449201,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br,322.0298,[M+H]+,20.0,val,Cc1nn(C)c(C(=O)N/N=C/c2cccnc2)c1Br
449202,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1,322.0298,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1
449203,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1,322.0298,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1
449204,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1,322.0298,[M+H]+,60.0,val,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1
449205,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1,322.0298,[M+H]+,30.0,val,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1
449206,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1,322.0298,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)cc1Br)c1ccncc1
449207,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1,322.0298,[M+H]+,20.0,val,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1
449208,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1,322.0298,[M+H]+,20.0,val,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1
449209,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1,322.0298,[M+H]+,45.0,val,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1
449210,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1,322.0298,[M+H]+,60.0,val,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1
449211,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1,322.0298,[M+H]+,20.0,val,O=C(c1cnccn1)N1CC(Cn2cc(Br)cn2)C1
449212,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,20.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449213,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,20.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449214,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,60.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449215,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,15.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449216,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,20.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449217,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,60.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449218,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,15.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449219,O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2)CC1(F)F,338.00709,[M-H]-,20.0,val,O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F
449220,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,20.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449221,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,20.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449222,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,30.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449223,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,60.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449224,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,15.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449225,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,20.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449226,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,60.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449227,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1,338.00709,[M-H]-,20.0,val,O=C(NS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCCCO1
449228,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449229,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449230,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,60.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449231,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,30.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449232,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449233,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,60.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449234,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,30.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449235,O=C(O)c1cc(Cl)c(S(=O)(=O)NC2CCC(F)(F)C2)cc1,338.00709,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)NC2CCC(F)(F)C2)c(Cl)c1
449236,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,20.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449237,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,20.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449238,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,60.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449239,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,15.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449240,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,20.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449241,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,45.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449242,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,60.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449243,Cn1ncc(-c2nc3c(ccc(Cl)c3)n2C)c1N,262.0854,[M+H]+,20.0,val,Cn1ncc(-c2nc3cc(Cl)ccc3n2C)c1N
449244,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449245,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449246,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,60.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449247,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449248,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449249,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,60.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449250,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449251,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449252,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449253,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449254,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449255,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449256,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449257,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449258,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449259,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449260,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449261,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449262,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449263,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,60.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449264,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449265,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449266,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,60.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449267,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,30.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449268,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,252.0433,[M-H]-,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449269,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449270,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449271,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,60.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449272,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,30.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449273,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449274,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,60.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449275,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,30.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449276,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,252.0433,[M-H]-,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449277,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449278,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449279,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,60.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449280,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,30.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449281,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449282,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,30.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449283,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,252.0433,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449284,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449285,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449286,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449287,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449288,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449289,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449290,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449291,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccc(Cl)cc2)C1
449292,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449293,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449294,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449295,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449296,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449297,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,60.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449298,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,30.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449299,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1,254.05785,[M+H]+,20.0,val,O=C(O)C1CC(=O)N(Cc2ccccc2Cl)C1
449300,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449301,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449302,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,60.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449303,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,30.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449304,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449305,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,60.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449306,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,30.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449307,CN1C(=O)CC(C(=O)O)C1c1cc(Cl)ccc1,254.05785,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)O)C1c1cccc(Cl)c1
449308,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449309,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449310,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,60.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449311,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,30.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449312,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449313,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,60.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449314,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,30.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449315,Cc1c(N2CC(C(=O)O)CC2=O)cc(Cl)cc1,254.05785,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CC(C(=O)O)CC1=O
449316,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449317,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449318,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,60.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449319,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,15.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449320,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449321,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,60.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449322,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,15.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449323,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,274.06965,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449324,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449325,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449326,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,60.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449327,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,15.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449328,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449329,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,60.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449330,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,15.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449331,CC(=O)NC(C)(C(=O)O)c1cc(C(F)(F)F)ccc1,276.0842,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)c1cccc(C(F)(F)F)c1
449332,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449333,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449334,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,60.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449335,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,30.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449336,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449337,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449338,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,30.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449339,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,274.06965,[M-H]-,60.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449340,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449341,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449342,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,60.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449343,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,30.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449344,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449345,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,20.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449346,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,30.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449347,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1,276.0842,[M+H]+,60.0,val,O=C(O)c1cc(C(F)(F)F)ccc1N1CCOCC1
449348,O=C(O)c1cc(NC(=O)[C@@H]2CCCO2)c(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)c1ccc(F)c(NC(=O)[C@@H]2CCCO2)c1
449349,O=C(O)c1cc(NC(=O)[C@@H]2CCCO2)c(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)c1ccc(F)c(NC(=O)[C@@H]2CCCO2)c1
449350,O=C(O)c1cc(NC(=O)[C@@H]2CCCO2)c(F)cc1,252.06776,[M-H]-,60.0,val,O=C(O)c1ccc(F)c(NC(=O)[C@@H]2CCCO2)c1
449351,O=C(O)c1cc(NC(=O)[C@@H]2CCCO2)c(F)cc1,252.06776,[M-H]-,30.0,val,O=C(O)c1ccc(F)c(NC(=O)[C@@H]2CCCO2)c1
449352,O=C(O)c1cc(NC(=O)[C@@H]2CCCO2)c(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)c1ccc(F)c(NC(=O)[C@@H]2CCCO2)c1
449353,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449354,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449355,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,60.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449356,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,30.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449357,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449358,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,60.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449359,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,30.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449360,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,252.06776,[M-H]-,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449361,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449362,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449363,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,60.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449364,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,30.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449365,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449366,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,60.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449367,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,30.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449368,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1,254.08231,[M+H]+,20.0,val,O=C(O)C1CC(O)CN1C(=O)c1ccc(F)cc1
449369,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449370,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449371,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,60.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449372,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,30.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449373,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449374,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,60.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449375,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,30.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449376,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,247.05467,[M-H]-,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449377,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449378,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449379,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,60.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449380,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,30.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449381,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449382,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,60.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449383,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,30.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449384,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1,249.06922,[M+H]+,20.0,val,CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1
449385,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449386,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449387,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,60.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449388,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449389,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449390,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449391,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449392,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449393,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,60.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449394,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449395,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449396,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449397,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,60.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449398,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,30.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449399,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449400,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,248.0625,[M]-,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449401,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,248.0625,[M]-,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449402,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,248.0625,[M]-,60.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449403,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,248.0625,[M]-,30.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449404,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,248.0625,[M]-,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449405,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449406,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449407,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,60.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449408,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449409,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,247.05467,[M-H]-,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449410,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449411,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449412,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,60.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449413,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,30.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449414,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449415,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,60.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449416,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,30.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449417,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1,249.06922,[M+H]+,20.0,val,Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
449418,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449419,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449420,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,60.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449421,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,30.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449422,CSc1ccc(C(=O)c2c(C)[nH]c(=O)[nH]2)cc1,249.06922,[M+H]+,20.0,val,CSc1ccc(C(=O)c2[nH]c(=O)[nH]c2C)cc1
449423,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,20.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449424,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,20.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449425,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,60.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449426,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,30.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449427,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,20.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449428,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,60.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449429,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,30.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449430,Cc1cc2c(cc1C)c(CC(=O)O)co2,204.0781,[M]+,20.0,val,Cc1cc2occ(CC(=O)O)c2cc1C
449431,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,20.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449432,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,20.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449433,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,60.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449434,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,30.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449435,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,20.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449436,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,60.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449437,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,30.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449438,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1,203.07137,[M-H]-,20.0,val,CC(=O)/C=C(O)/C=C/c1ccc(O)cc1
449439,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,20.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449440,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,20.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449441,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,30.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449442,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,60.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449443,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,20.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449444,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,45.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449445,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,60.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449446,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O,422.91481,[M-H]-,20.0,val,CN(c1cccc(NS(=O)(=O)c2ccc(Br)s2)c1)S(C)(=O)=O
449447,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,20.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449448,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,20.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449449,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,60.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449450,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,30.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449451,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,20.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449452,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,30.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449453,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,20.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449454,O=C(NC1CCCC1)c1cc(I)ccc1Cl,349.98032,[M+H]+,60.0,val,O=C(NC1CCCC1)c1cc(I)ccc1Cl
449455,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,20.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449456,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,20.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449457,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,60.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449458,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,30.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449459,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,20.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449460,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,60.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449461,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,30.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449462,CC(C)(C)C(=O)NS(=O)(=O)c1cc(Cl)c(C#N)cc1,299.02627,[M-H]-,20.0,val,CC(C)(C)C(=O)NS(=O)(=O)c1ccc(C#N)c(Cl)c1
449463,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,300.06238,[M-H]-,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449464,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,300.06238,[M-H]-,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449465,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,300.06238,[M-H]-,45.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449466,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,300.06238,[M-H]-,60.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449467,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,300.06238,[M-H]-,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449468,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,302.07693,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449469,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,302.07693,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449470,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,302.07693,[M+H]+,60.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449471,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,302.07693,[M+H]+,30.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449472,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1,302.07693,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(F)c2)c1
449473,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,273.08564,[M-H]-,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449474,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,273.08564,[M-H]-,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449475,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,273.08564,[M-H]-,60.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449476,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,273.08564,[M-H]-,30.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449477,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,273.08564,[M-H]-,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449478,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,257.08963,[M+H-H2O]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449479,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,257.08963,[M+H-H2O]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449480,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,257.08963,[M+H-H2O]+,60.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449481,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,257.08963,[M+H-H2O]+,30.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449482,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,257.08963,[M+H-H2O]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449483,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449484,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449485,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,60.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449486,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,30.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449487,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449488,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,60.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449489,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,30.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449490,CC1CN(c2c(C(F)(F)F)cccn2)CC1C(=O)O,275.10019,[M+H]+,20.0,val,CC1CN(c2ncccc2C(F)(F)F)CC1C(=O)O
449491,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449492,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449493,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449494,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,30.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449495,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449496,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449497,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,30.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449498,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449499,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,257.08963,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449500,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,257.08963,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449501,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,257.08963,[M+H-H2O]+,60.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449502,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,257.08963,[M+H-H2O]+,30.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449503,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,257.08963,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449504,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449505,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449506,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449507,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,30.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449508,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449509,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449510,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,30.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449511,O=C(O)C1CCCN(c2c(C(F)(F)F)cccn2)C1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCCN(c2ncccc2C(F)(F)F)C1
449512,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449513,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449514,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,30.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449515,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449516,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449517,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,45.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449518,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,30.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449519,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449520,O=C(O)C1CCN(c2ncc(C(F)(F)F)cc2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449521,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449522,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449523,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,273.08564,[M-H]-,45.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449524,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,273.08564,[M-H]-,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449525,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,273.08564,[M-H]-,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449526,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449527,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449528,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,45.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449529,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449530,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449531,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,45.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449532,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,20.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449533,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1,275.10019,[M+H]+,60.0,val,O=C(O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1
449534,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,307.07828,[M-H]-,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449535,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,307.07828,[M-H]-,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449536,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,307.07828,[M-H]-,60.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449537,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,307.07828,[M-H]-,15.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449538,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,307.07828,[M-H]-,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449539,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,309.09283,[M+H]+,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449540,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,309.09283,[M+H]+,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449541,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,309.09283,[M+H]+,60.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449542,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,309.09283,[M+H]+,15.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449543,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1,309.09283,[M+H]+,20.0,val,CCCn1nnc(NC(=S)NC(=O)c2ccc(F)cc2)n1
449544,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,30.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449545,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,30.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449546,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,20.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449547,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,60.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449548,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,30.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449549,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,20.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449550,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,60.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449551,O=C(c1cscn1)N1CCN(c2ncccn2)CC1,276.09136,[M+H]+,30.0,val,O=C(c1cscn1)N1CCN(c2ncccn2)CC1
449552,CC1=Nc2cccc(C(=O)O)c2C1(C)C,202.08735,[M-H]-,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449553,CC1=Nc2cccc(C(=O)O)c2C1(C)C,202.08735,[M-H]-,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449554,CC1=Nc2cccc(C(=O)O)c2C1(C)C,202.08735,[M-H]-,30.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449555,CC1=Nc2cccc(C(=O)O)c2C1(C)C,202.08735,[M-H]-,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449556,Cc1cc2c(cc1)n(CCC(=O)O)cc2,202.08735,[M-H]-,20.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449557,Cc1cc2c(cc1)n(CCC(=O)O)cc2,202.08735,[M-H]-,20.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449558,Cc1cc2c(cc1)n(CCC(=O)O)cc2,202.08735,[M-H]-,60.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449559,Cc1cc2c(cc1)n(CCC(=O)O)cc2,202.08735,[M-H]-,15.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449560,Cc1cc2c(cc1)n(CCC(=O)O)cc2,202.08735,[M-H]-,20.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449561,CC(Cn1ccc2ccccc21)C(=O)O,202.08735,[M-H]-,20.0,val,CC(Cn1ccc2ccccc21)C(=O)O
449562,CC(Cn1ccc2ccccc21)C(=O)O,202.08735,[M-H]-,20.0,val,CC(Cn1ccc2ccccc21)C(=O)O
449563,CC(Cn1ccc2ccccc21)C(=O)O,202.08735,[M-H]-,60.0,val,CC(Cn1ccc2ccccc21)C(=O)O
449564,CC(Cn1ccc2ccccc21)C(=O)O,202.08735,[M-H]-,30.0,val,CC(Cn1ccc2ccccc21)C(=O)O
449565,CC(Cn1ccc2ccccc21)C(=O)O,202.08735,[M-H]-,20.0,val,CC(Cn1ccc2ccccc21)C(=O)O
449566,Cc1cc2c(cc1)[nH]c(C)c2CC(=O)O,204.1019,[M+H]+,20.0,val,Cc1ccc2[nH]c(C)c(CC(=O)O)c2c1
449567,Cc1cc2c(cc1)[nH]c(C)c2CC(=O)O,204.1019,[M+H]+,20.0,val,Cc1ccc2[nH]c(C)c(CC(=O)O)c2c1
449568,Cc1cc2c(cc1)[nH]c(C)c2CC(=O)O,204.1019,[M+H]+,60.0,val,Cc1ccc2[nH]c(C)c(CC(=O)O)c2c1
449569,Cc1cc2c(cc1)[nH]c(C)c2CC(=O)O,204.1019,[M+H]+,30.0,val,Cc1ccc2[nH]c(C)c(CC(=O)O)c2c1
449570,Cc1cc2c(cc1)[nH]c(C)c2CC(=O)O,204.1019,[M+H]+,20.0,val,Cc1ccc2[nH]c(C)c(CC(=O)O)c2c1
449571,Cn1cc(CCC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,Cn1cc(CCC(=O)O)c2ccccc21
449572,Cn1cc(CCC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,Cn1cc(CCC(=O)O)c2ccccc21
449573,Cn1cc(CCC(=O)O)c2ccccc21,204.1019,[M+H]+,60.0,val,Cn1cc(CCC(=O)O)c2ccccc21
449574,Cn1cc(CCC(=O)O)c2ccccc21,204.1019,[M+H]+,30.0,val,Cn1cc(CCC(=O)O)c2ccccc21
449575,Cn1cc(CCC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,Cn1cc(CCC(=O)O)c2ccccc21
449576,Cc1cc2c(cc1)n(CCC(=O)O)cc2,204.1019,[M+H]+,30.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449577,Cc1cc2c(cc1)n(CCC(=O)O)cc2,204.1019,[M+H]+,30.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449578,Cc1cc2c(cc1)n(CCC(=O)O)cc2,204.1019,[M+H]+,20.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449579,Cc1cc2c(cc1)n(CCC(=O)O)cc2,204.1019,[M+H]+,60.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449580,Cc1cc2c(cc1)n(CCC(=O)O)cc2,204.1019,[M+H]+,30.0,val,Cc1ccc2c(ccn2CCC(=O)O)c1
449581,CC(C(=O)O)c1cn(C)c2ccccc12,204.1019,[M+H]+,20.0,val,CC(C(=O)O)c1cn(C)c2ccccc12
449582,CC(C(=O)O)c1cn(C)c2ccccc12,204.1019,[M+H]+,20.0,val,CC(C(=O)O)c1cn(C)c2ccccc12
449583,CC(C(=O)O)c1cn(C)c2ccccc12,204.1019,[M+H]+,60.0,val,CC(C(=O)O)c1cn(C)c2ccccc12
449584,CC(C(=O)O)c1cn(C)c2ccccc12,204.1019,[M+H]+,30.0,val,CC(C(=O)O)c1cn(C)c2ccccc12
449585,CC(C(=O)O)c1cn(C)c2ccccc12,204.1019,[M+H]+,20.0,val,CC(C(=O)O)c1cn(C)c2ccccc12
449586,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,203.09408,[M]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449587,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,203.09408,[M]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449588,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,203.09408,[M]+,60.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449589,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,203.09408,[M]+,30.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449590,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,203.09408,[M]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449591,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,204.1019,[M+H]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449592,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,204.1019,[M+H]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449593,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,204.1019,[M+H]+,60.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449594,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,204.1019,[M+H]+,30.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449595,Cc1cc2c(cc1)c(CCC(=O)O)c[nH]2,204.1019,[M+H]+,20.0,val,Cc1ccc2c(CCC(=O)O)c[nH]c2c1
449596,Cc1c2c(CCC(=O)O)c[nH]c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCC(=O)O)c12
449597,Cc1c2c(CCC(=O)O)c[nH]c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCC(=O)O)c12
449598,Cc1c2c(CCC(=O)O)c[nH]c2ccc1,204.1019,[M+H]+,60.0,val,Cc1cccc2[nH]cc(CCC(=O)O)c12
449599,Cc1c2c(CCC(=O)O)c[nH]c2ccc1,204.1019,[M+H]+,30.0,val,Cc1cccc2[nH]cc(CCC(=O)O)c12
449600,Cc1c2c(CCC(=O)O)c[nH]c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCC(=O)O)c12
449601,CCc1c2[nH]cc(CC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,CCc1cccc2c(CC(=O)O)c[nH]c12
449602,CCc1c2[nH]cc(CC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,CCc1cccc2c(CC(=O)O)c[nH]c12
449603,CCc1c2[nH]cc(CC(=O)O)c2ccc1,204.1019,[M+H]+,60.0,val,CCc1cccc2c(CC(=O)O)c[nH]c12
449604,CCc1c2[nH]cc(CC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,CCc1cccc2c(CC(=O)O)c[nH]c12
449605,CCc1c2[nH]cc(CC(=O)O)c2ccc1,204.1019,[M+H]+,45.0,val,CCc1cccc2c(CC(=O)O)c[nH]c12
449606,Cc1c2[nH]cc(CCC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2c(CCC(=O)O)c[nH]c12
449607,Cc1c2[nH]cc(CCC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2c(CCC(=O)O)c[nH]c12
449608,Cc1c2[nH]cc(CCC(=O)O)c2ccc1,204.1019,[M+H]+,60.0,val,Cc1cccc2c(CCC(=O)O)c[nH]c12
449609,Cc1c2[nH]cc(CCC(=O)O)c2ccc1,204.1019,[M+H]+,30.0,val,Cc1cccc2c(CCC(=O)O)c[nH]c12
449610,Cc1c2[nH]cc(CCC(=O)O)c2ccc1,204.1019,[M+H]+,20.0,val,Cc1cccc2c(CCC(=O)O)c[nH]c12
449611,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449612,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449613,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,60.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449614,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449615,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,45.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449616,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,60.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449617,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,20.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449618,CC1=Nc2cccc(C(=O)O)c2C1(C)C,204.1019,[M+H]+,45.0,val,CC1=Nc2cccc(C(=O)O)c2C1(C)C
449619,CCn1cc(CC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,CCn1cc(CC(=O)O)c2ccccc21
449620,CCn1cc(CC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,CCn1cc(CC(=O)O)c2ccccc21
449621,CCn1cc(CC(=O)O)c2ccccc21,204.1019,[M+H]+,60.0,val,CCn1cc(CC(=O)O)c2ccccc21
449622,CCn1cc(CC(=O)O)c2ccccc21,204.1019,[M+H]+,30.0,val,CCn1cc(CC(=O)O)c2ccccc21
449623,CCn1cc(CC(=O)O)c2ccccc21,204.1019,[M+H]+,20.0,val,CCn1cc(CC(=O)O)c2ccccc21
449624,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,234.07718,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449625,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,234.07718,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449626,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,234.07718,[M-H]-,60.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449627,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,234.07718,[M-H]-,30.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449628,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,234.07718,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449629,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449630,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449631,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,60.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449632,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,30.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449633,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449634,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,60.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449635,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,30.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449636,O=C(O)C1CCCN1C(=O)c1ccccc1O,234.07718,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)c1ccccc1O
449637,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449638,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449639,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,60.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449640,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,30.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449641,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449642,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,60.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449643,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,30.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449644,COc1ccccc1N1CC(C(=O)O)CC1=O,234.07718,[M-H]-,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449645,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449646,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449647,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,60.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449648,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,30.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449649,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449650,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,60.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449651,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,30.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449652,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,234.07718,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449653,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449654,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449655,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,60.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449656,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,30.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449657,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449658,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,60.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449659,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,30.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449660,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,234.07718,[M-H]-,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449661,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449662,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449663,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,60.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449664,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,30.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449665,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449666,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,60.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449667,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,30.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449668,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,236.09173,[M+H]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449669,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,258.07368,[M+Na]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449670,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,258.07368,[M+Na]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449671,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,258.07368,[M+Na]+,30.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449672,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O,258.07368,[M+Na]+,20.0,val,CC(O)(CN1Cc2ccccc2C1=O)C(=O)O
449673,COc1cccc(N2CC(C(=O)O)CC2=O)c1,200.07061,[M+H-2H2O]+,20.0,val,COc1cccc(N2CC(C(=O)O)CC2=O)c1
449674,COc1cccc(N2CC(C(=O)O)CC2=O)c1,200.07061,[M+H-2H2O]+,20.0,val,COc1cccc(N2CC(C(=O)O)CC2=O)c1
449675,COc1cccc(N2CC(C(=O)O)CC2=O)c1,200.07061,[M+H-2H2O]+,60.0,val,COc1cccc(N2CC(C(=O)O)CC2=O)c1
449676,COc1cccc(N2CC(C(=O)O)CC2=O)c1,200.07061,[M+H-2H2O]+,20.0,val,COc1cccc(N2CC(C(=O)O)CC2=O)c1
449677,COc1cccc(N2CC(C(=O)O)CC2=O)c1,200.07061,[M+H-2H2O]+,45.0,val,COc1cccc(N2CC(C(=O)O)CC2=O)c1
449678,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449679,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449680,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,60.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449681,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,30.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449682,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449683,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,60.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449684,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,30.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449685,COc1ccc(N2CC(C(=O)O)CC2=O)cc1,236.09173,[M+H]+,20.0,val,COc1ccc(N2CC(C(=O)O)CC2=O)cc1
449686,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1,236.09173,[M+H]+,20.0,val,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1
449687,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1,236.09173,[M+H]+,20.0,val,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1
449688,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1,236.09173,[M+H]+,60.0,val,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1
449689,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1,236.09173,[M+H]+,30.0,val,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1
449690,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1,236.09173,[M+H]+,20.0,val,COc1cc(OC)c2cc(C(=O)O)n(C)c2c1
449691,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449692,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449693,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,60.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449694,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,15.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449695,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449696,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,60.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449697,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,15.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449698,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,236.09173,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449699,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,253.11828,[M+NH4]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449700,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,253.11828,[M+NH4]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449701,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,253.11828,[M+NH4]+,60.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449702,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,253.11828,[M+NH4]+,15.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449703,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,253.11828,[M+NH4]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449704,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,258.07368,[M+Na]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449705,O=C(O)c1cc(NC(=O)C2CCCO2)ccc1,258.07368,[M+Na]+,20.0,val,O=C(O)c1cccc(NC(=O)C2CCCO2)c1
449706,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449707,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449708,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,60.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449709,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,30.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449710,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449711,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,60.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449712,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,30.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449713,COc1ccccc1N1CC(C(=O)O)CC1=O,236.09173,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)O)CC1=O
449714,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,218.08117,[M+H-H2O]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449715,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,218.08117,[M+H-H2O]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449716,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,218.08117,[M+H-H2O]+,60.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449717,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,218.08117,[M+H-H2O]+,30.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449718,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,218.08117,[M+H-H2O]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449719,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,236.09173,[M+H]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449720,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,236.09173,[M+H]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449721,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,236.09173,[M+H]+,60.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449722,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,236.09173,[M+H]+,15.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449723,COC(=O)CC1CC(c2ccc(O)cc2)=NO1,236.09173,[M+H]+,20.0,val,COC(=O)CC1CC(c2ccc(O)cc2)=NO1
449724,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl,337.0242,[M+H]+,20.0,val,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl
449725,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl,337.0242,[M+H]+,20.0,val,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl
449726,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl,337.0242,[M+H]+,60.0,val,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl
449727,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl,337.0242,[M+H]+,30.0,val,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl
449728,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl,337.0242,[M+H]+,20.0,val,CCS(=O)(=O)N1CCN=C1SCc1c(F)cccc1Cl
449729,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,20.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449730,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,20.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449731,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,60.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449732,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,15.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449733,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,20.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449734,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,15.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449735,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,20.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449736,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1,316.05172,[M+H]+,60.0,val,CS(=O)(=O)CCC(N)c1nc(-c2ccc(Cl)cc2)no1
449737,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449738,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449739,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,60.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449740,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,30.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449741,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449742,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,60.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449743,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,30.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449744,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,270.05386,[M-H]-,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449745,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,272.06841,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449746,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,272.06841,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449747,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,272.06841,[M+H]+,60.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449748,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,272.06841,[M+H]+,30.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449749,Cc1c(Cl)cc(C(=O)NCC(C)(O)C(=O)O)cc1,272.06841,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(C)(O)C(=O)O)cc1Cl
449750,Nc1ncc2CN(C(=O)[C@H]3C[C@@H]3C(F)F)CCc2n1,269.12084,[M+H]+,20.0,val,Nc1ncc2c(n1)CCN(C(=O)[C@H]1C[C@@H]1C(F)F)C2
449751,Nc1ncc2CN(C(=O)[C@H]3C[C@@H]3C(F)F)CCc2n1,269.12084,[M+H]+,20.0,val,Nc1ncc2c(n1)CCN(C(=O)[C@H]1C[C@@H]1C(F)F)C2
449752,Nc1ncc2CN(C(=O)[C@H]3C[C@@H]3C(F)F)CCc2n1,269.12084,[M+H]+,60.0,val,Nc1ncc2c(n1)CCN(C(=O)[C@H]1C[C@@H]1C(F)F)C2
449753,Nc1ncc2CN(C(=O)[C@H]3C[C@@H]3C(F)F)CCc2n1,269.12084,[M+H]+,20.0,val,Nc1ncc2c(n1)CCN(C(=O)[C@H]1C[C@@H]1C(F)F)C2
449754,Nc1ncc2CN(C(=O)[C@H]3C[C@@H]3C(F)F)CCc2n1,269.12084,[M+H]+,45.0,val,Nc1ncc2c(n1)CCN(C(=O)[C@H]1C[C@@H]1C(F)F)C2
449755,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449756,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449757,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,60.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449758,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,30.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449759,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449760,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,45.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449761,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449762,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,327.08451,[M-H]-,60.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449763,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449764,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449765,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,45.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449766,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,60.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449767,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449768,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,45.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449769,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,60.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449770,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,329.09906,[M+H]+,20.0,val,Cc1nsc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
449771,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449772,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449773,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,45.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449774,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,60.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449775,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449776,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,45.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449777,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,60.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449778,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,324.05229,[M-H]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449779,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,360.02897,[M+Cl]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449780,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,360.02897,[M+Cl]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449781,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,360.02897,[M+Cl]-,60.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449782,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,360.02897,[M+Cl]-,15.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449783,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1,360.02897,[M+Cl]-,20.0,val,O=S(=O)(NCC1(O)CCOC1)c1ccc(C(F)(F)F)cc1
449784,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,20.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449785,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,20.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449786,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,60.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449787,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,30.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449788,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,20.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449789,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,60.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449790,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,30.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449791,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1,302.0504,[M-H]-,20.0,val,Cc1cc(F)cc(S(=O)(=O)N2CCOCC2C(=O)O)c1
449792,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449793,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449794,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449795,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449796,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449797,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449798,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449799,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,302.0504,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449800,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,348.05587,[M+FA]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449801,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,348.05587,[M+FA]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449802,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,348.05587,[M+FA]-,60.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449803,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,348.05587,[M+FA]-,15.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449804,Cc1c(F)c(S(=O)(=O)N2CCOC(C(=O)O)C2)ccc1,348.05587,[M+FA]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCOC(C(=O)O)C2)c1F
449805,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449806,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449807,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,60.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449808,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449809,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,45.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449810,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,60.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449811,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449812,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,217.09825,[M-H]-,45.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449813,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449814,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449815,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,60.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449816,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,30.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449817,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449818,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,60.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449819,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,30.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449820,CC(C)C(C(=O)O)n1cnc2ccccc21,217.09825,[M-H]-,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449821,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449822,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449823,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,60.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449824,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449825,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,45.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449826,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,60.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449827,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,20.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449828,CC(C)C(C(=O)O)n1cnc2ccccc21,219.1128,[M+H]+,45.0,val,CC(C)C(C(=O)O)n1cnc2ccccc21
449829,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449830,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449831,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,60.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449832,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,15.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449833,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449834,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,60.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449835,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,15.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449836,CN(C)Cc1c[nH]c2c1cc(C(=O)O)cc2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2ccc(C(=O)O)cc12
449837,CN(C)Cc1c[nH]c2c1ccc(C(=O)O)c2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2cc(C(=O)O)ccc12
449838,CN(C)Cc1c[nH]c2c1ccc(C(=O)O)c2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2cc(C(=O)O)ccc12
449839,CN(C)Cc1c[nH]c2c1ccc(C(=O)O)c2,219.1128,[M+H]+,60.0,val,CN(C)Cc1c[nH]c2cc(C(=O)O)ccc12
449840,CN(C)Cc1c[nH]c2c1ccc(C(=O)O)c2,219.1128,[M+H]+,15.0,val,CN(C)Cc1c[nH]c2cc(C(=O)O)ccc12
449841,CN(C)Cc1c[nH]c2c1ccc(C(=O)O)c2,219.1128,[M+H]+,20.0,val,CN(C)Cc1c[nH]c2cc(C(=O)O)ccc12
449842,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,201.10224,[M+H-H2O]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449843,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,201.10224,[M+H-H2O]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449844,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,201.10224,[M+H-H2O]+,60.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449845,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,201.10224,[M+H-H2O]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449846,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,201.10224,[M+H-H2O]+,45.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449847,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449848,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449849,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,60.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449850,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,30.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449851,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449852,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,60.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449853,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,30.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449854,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O,219.1128,[M+H]+,20.0,val,CC(C)(Cc1nc2ccccc2[nH]1)C(=O)O
449855,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,219.1128,[M+H]+,20.0,val,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
449856,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,219.1128,[M+H]+,20.0,val,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
449857,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,219.1128,[M+H]+,60.0,val,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
449858,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,219.1128,[M+H]+,30.0,val,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
449859,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,219.1128,[M+H]+,20.0,val,CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
449860,CC(=O)NCCc1c[nH]c2c1cc(O)cc2,219.1128,[M+H]+,20.0,val,CC(=O)NCCc1c[nH]c2ccc(O)cc12
449861,CC(=O)NCCc1c[nH]c2c1cc(O)cc2,219.1128,[M+H]+,20.0,val,CC(=O)NCCc1c[nH]c2ccc(O)cc12
449862,CC(=O)NCCc1c[nH]c2c1cc(O)cc2,219.1128,[M+H]+,60.0,val,CC(=O)NCCc1c[nH]c2ccc(O)cc12
449863,CC(=O)NCCc1c[nH]c2c1cc(O)cc2,219.1128,[M+H]+,15.0,val,CC(=O)NCCc1c[nH]c2ccc(O)cc12
449864,CC(=O)NCCc1c[nH]c2c1cc(O)cc2,219.1128,[M+H]+,20.0,val,CC(=O)NCCc1c[nH]c2ccc(O)cc12
449865,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21,219.1128,[M+H]+,20.0,val,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21
449866,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21,219.1128,[M+H]+,20.0,val,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21
449867,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21,219.1128,[M+H]+,60.0,val,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21
449868,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21,219.1128,[M+H]+,15.0,val,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21
449869,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21,219.1128,[M+H]+,20.0,val,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21
449870,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,20.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449871,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,20.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449872,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,60.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449873,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,20.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449874,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,20.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449875,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,219.1128,[M+H]+,60.0,val,O=CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
449876,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449877,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449878,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,233.09317,[M-H]-,60.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449879,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449880,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449881,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449882,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449883,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,60.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449884,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,30.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449885,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449886,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,60.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449887,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,30.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449888,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,233.09317,[M-H]-,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
449889,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
449890,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
449891,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,233.09317,[M-H]-,60.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
449892,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
449893,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
449894,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449895,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449896,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,60.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449897,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,30.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449898,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449899,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,60.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449900,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,30.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449901,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,233.09317,[M-H]-,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
449902,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449903,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449904,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,60.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449905,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,15.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449906,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449907,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,60.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449908,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,15.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449909,O=C(O)CNC(=O)N1CCc2ccccc2C1,233.09317,[M-H]-,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
449910,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449911,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449912,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,60.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449913,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,30.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449914,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449915,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,60.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449916,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,30.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449917,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,233.09317,[M-H]-,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449918,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,233.09317,[M-H]-,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449919,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,233.09317,[M-H]-,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449920,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,233.09317,[M-H]-,60.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449921,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,233.09317,[M-H]-,30.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449922,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,233.09317,[M-H]-,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449923,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449924,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449925,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449926,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449927,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449928,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449929,O=C(O)CN1CCC(c2ccccc2)NC1=O,233.09317,[M-H]-,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
449930,O=C(O)CN1CCC(c2ccccc2)NC1=O,233.09317,[M-H]-,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
449931,O=C(O)CN1CCC(c2ccccc2)NC1=O,233.09317,[M-H]-,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
449932,O=C(O)CN1CCC(c2ccccc2)NC1=O,233.09317,[M-H]-,60.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
449933,O=C(O)CN1CCC(c2ccccc2)NC1=O,233.09317,[M-H]-,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
449934,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449935,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449936,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,60.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449937,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,30.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449938,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449939,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,60.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449940,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,30.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449941,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,233.09317,[M-H]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449942,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,269.06984,[M+Cl]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449943,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,269.06984,[M+Cl]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449944,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,269.06984,[M+Cl]-,15.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449945,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,269.06984,[M+Cl]-,60.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449946,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,269.06984,[M+Cl]-,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
449947,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449948,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449949,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,60.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449950,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449951,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449952,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,60.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449953,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,30.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449954,O=C(O)C1CCCCN1C(=O)c1cnccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449955,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449956,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449957,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449958,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449959,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449960,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449961,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449962,O=C(O)C1CCCCN1C(=O)c1cnccc1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCCCN1C(=O)c1cccnc1
449963,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449964,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449965,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,60.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449966,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,30.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449967,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449968,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,60.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449969,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,30.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449970,CC1Nc2c(cc(C(=O)O)cc2)NC(=O)C1C,235.10772,[M+H]+,20.0,val,CC1Nc2ccc(C(=O)O)cc2NC(=O)C1C
449971,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449972,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449973,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449974,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449975,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449976,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449977,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449978,O=C(O)C1CCN(C(=O)c2cnccc2)CC1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCN(C(=O)c2cccnc2)CC1
449979,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,217.09716,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449980,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,217.09716,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449981,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,217.09716,[M+H-H2O]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449982,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,217.09716,[M+H-H2O]+,30.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449983,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,217.09716,[M+H-H2O]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449984,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449985,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449986,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,30.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449987,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449988,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449989,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449990,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449991,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449992,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,257.08966,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449993,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,257.08966,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449994,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,257.08966,[M+Na]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449995,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,257.08966,[M+Na]+,30.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449996,O=C(O)C1CCCN(C(=O)c2ccccn2)C1,257.08966,[M+Na]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccccn2)C1
449997,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449998,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
449999,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,60.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450000,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450001,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,45.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450002,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,60.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450003,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,20.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450004,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cnccc1,235.10772,[M+H]+,45.0,val,CCN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1
450005,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450006,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450007,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,60.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450008,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450009,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,45.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450010,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,60.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450011,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,20.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450012,Cc1c(CCC(=O)O)c(C)c2c(C)noc2n1,235.10772,[M+H]+,45.0,val,Cc1nc2onc(C)c2c(C)c1CCC(=O)O
450013,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450014,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450015,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450016,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450017,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450018,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450019,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450020,O=C(O)C1CCCN(C(=O)c2ccncc2)C1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCCN(C(=O)c2ccncc2)C1
450021,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450022,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450023,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,60.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450024,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,15.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450025,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450026,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,60.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450027,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,15.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450028,O=C(O)CNC(=O)N1CCc2ccccc2C1,235.10772,[M+H]+,20.0,val,O=C(O)CNC(=O)N1CCc2ccccc2C1
450029,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450030,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450031,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,60.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450032,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,15.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450033,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450034,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,60.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450035,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,15.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450036,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,235.10772,[M+H]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450037,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,257.08966,[M+Na]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450038,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,257.08966,[M+Na]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450039,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,257.08966,[M+Na]+,60.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450040,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,257.08966,[M+Na]+,30.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450041,CC1(NC(=O)c2nc(C(=O)O)ccc2)CCC1,257.08966,[M+Na]+,20.0,val,CC1(NC(=O)c2cccc(C(=O)O)n2)CCC1
450042,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450043,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450044,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,30.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450045,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450046,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450047,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,45.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450048,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450049,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450050,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,257.08966,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450051,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,257.08966,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450052,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,257.08966,[M+Na]+,20.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450053,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,257.08966,[M+Na]+,60.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450054,O=C(O)C1CCN(C(=O)c2ccccn2)CC1,257.08966,[M+Na]+,30.0,val,O=C(O)C1CCN(C(=O)c2ccccn2)CC1
450055,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,235.10772,[M+H]+,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
450056,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,235.10772,[M+H]+,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
450057,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,235.10772,[M+H]+,60.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
450058,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,235.10772,[M+H]+,30.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
450059,CC(C)(C)Cc1noc2c1cc(C(=O)O)cn2,235.10772,[M+H]+,20.0,val,CC(C)(C)Cc1noc2ncc(C(=O)O)cc12
450060,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450061,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450062,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,60.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450063,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450064,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450065,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,60.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450066,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450067,O=C(O)CN1CCC(c2ccccc2)NC1=O,235.10772,[M+H]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450068,O=C(O)CN1CCC(c2ccccc2)NC1=O,257.08966,[M+Na]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450069,O=C(O)CN1CCC(c2ccccc2)NC1=O,257.08966,[M+Na]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450070,O=C(O)CN1CCC(c2ccccc2)NC1=O,257.08966,[M+Na]+,60.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450071,O=C(O)CN1CCC(c2ccccc2)NC1=O,257.08966,[M+Na]+,30.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450072,O=C(O)CN1CCC(c2ccccc2)NC1=O,257.08966,[M+Na]+,20.0,val,O=C(O)CN1CCC(c2ccccc2)NC1=O
450073,O=C(O)C1CCCN1C(=O)Nc1ccccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450074,O=C(O)C1CCCN1C(=O)Nc1ccccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450075,O=C(O)C1CCCN1C(=O)Nc1ccccc1,233.09317,[M-H]-,60.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450076,O=C(O)C1CCCN1C(=O)Nc1ccccc1,233.09317,[M-H]-,15.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450077,O=C(O)C1CCCN1C(=O)Nc1ccccc1,233.09317,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450078,O=C(O)C1CCCN1C(=O)Nc1ccccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450079,O=C(O)C1CCCN1C(=O)Nc1ccccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450080,O=C(O)C1CCCN1C(=O)Nc1ccccc1,235.10772,[M+H]+,60.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450081,O=C(O)C1CCCN1C(=O)Nc1ccccc1,235.10772,[M+H]+,15.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450082,O=C(O)C1CCCN1C(=O)Nc1ccccc1,235.10772,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Nc1ccccc1
450083,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,233.09317,[M-H]-,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450084,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,233.09317,[M-H]-,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450085,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,233.09317,[M-H]-,60.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450086,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,233.09317,[M-H]-,30.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450087,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,233.09317,[M-H]-,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450088,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,235.10772,[M+H]+,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450089,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,235.10772,[M+H]+,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450090,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,235.10772,[M+H]+,60.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450091,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,235.10772,[M+H]+,15.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450092,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,235.10772,[M+H]+,20.0,val,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1
450093,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450094,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450095,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,60.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450096,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,30.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450097,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450098,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,60.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450099,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,30.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450100,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,313.03222,[M-H]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450101,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,359.0377,[M+FA]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450102,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,359.0377,[M+FA]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450103,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,359.0377,[M+FA]-,60.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450104,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,359.0377,[M+FA]-,15.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450105,CCN(c1cc(O)ccc1)S(=O)(=O)c1csnc1OC,359.0377,[M+FA]-,20.0,val,CCN(c1cccc(O)c1)S(=O)(=O)c1csnc1OC
450106,COc1c2nc(OC3CN(S(C)(=O)=O)C3)sc2ccc1,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450107,COc1c2nc(OC3CN(S(C)(=O)=O)C3)sc2ccc1,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450108,COc1c2nc(OC3CN(S(C)(=O)=O)C3)sc2ccc1,315.04677,[M+H]+,60.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450109,COc1c2nc(OC3CN(S(C)(=O)=O)C3)sc2ccc1,315.04677,[M+H]+,15.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450110,COc1c2nc(OC3CN(S(C)(=O)=O)C3)sc2ccc1,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450111,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450112,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450113,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,60.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450114,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,15.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450115,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450116,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,15.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450117,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,20.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450118,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12,315.04677,[M+H]+,60.0,val,COc1cccc2sc(OC3CN(S(C)(=O)=O)C3)nc12
450119,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,293.07139,[M-H]-,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450120,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,293.07139,[M-H]-,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450121,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,293.07139,[M-H]-,60.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450122,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,293.07139,[M-H]-,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450123,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,293.07139,[M-H]-,45.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450124,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,293.07139,[M-H]-,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450125,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,293.07139,[M-H]-,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450126,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,293.07139,[M-H]-,60.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450127,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,293.07139,[M-H]-,30.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450128,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,293.07139,[M-H]-,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450129,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,295.08594,[M+H]+,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450130,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,295.08594,[M+H]+,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450131,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,295.08594,[M+H]+,60.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450132,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,295.08594,[M+H]+,20.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450133,Cn1nncc1NS(=O)(=O)c1cc2c(cc1)OCCC2,295.08594,[M+H]+,45.0,val,Cn1nncc1NS(=O)(=O)c1ccc2c(c1)CCCO2
450134,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,295.08594,[M+H]+,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450135,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,295.08594,[M+H]+,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450136,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,295.08594,[M+H]+,60.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450137,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,295.08594,[M+H]+,30.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450138,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1,295.08594,[M+H]+,20.0,val,O=S(=O)(NCc1cn(-c2ccc(O)cc2)nn1)C1CC1
450139,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450140,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450141,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,60.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450142,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,30.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450143,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450144,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,60.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450145,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,30.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450146,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1,253.054,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)C2CCCC2)cc1
450147,COc1c(NC(=O)[C@@H]2CCCN2)cc(Cl)cc1,255.08948,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN1
450148,COc1c(NC(=O)[C@@H]2CCCN2)cc(Cl)cc1,255.08948,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN1
450149,COc1c(NC(=O)[C@@H]2CCCN2)cc(Cl)cc1,255.08948,[M+H]+,60.0,val,COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN1
450150,COc1c(NC(=O)[C@@H]2CCCN2)cc(Cl)cc1,255.08948,[M+H]+,30.0,val,COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN1
450151,COc1c(NC(=O)[C@@H]2CCCN2)cc(Cl)cc1,255.08948,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN1
450152,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450153,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450154,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,60.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450155,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,30.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450156,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450157,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,60.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450158,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,30.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450159,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,286.10087,[M-H]-,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450160,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,288.11542,[M+H]+,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450161,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,288.11542,[M+H]+,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450162,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,288.11542,[M+H]+,60.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450163,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,288.11542,[M+H]+,30.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450164,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1,288.11542,[M+H]+,20.0,val,O=C(O)Cn1cc(NC(=O)C2CCC(F)(F)CC2)cn1
450165,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,335.09726,[M-H]-,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450166,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,335.09726,[M-H]-,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450167,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,335.09726,[M-H]-,60.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450168,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,335.09726,[M-H]-,15.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450169,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,335.09726,[M-H]-,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450170,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450171,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450172,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,30.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450173,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,60.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450174,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,15.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450175,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450176,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,60.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450177,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O,337.11182,[M+H]+,20.0,val,Cn1c(=O)cc(N2CC[C@H](NC(=O)OCC(F)(F)F)C2)[nH]c1=O
450178,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,20.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450179,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,20.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450180,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,60.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450181,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,30.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450182,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,20.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450183,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,60.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450184,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,30.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450185,CCc1c(F)c(NCc2c(C)nc(C)s2)ncn1,267.10742,[M+H]+,20.0,val,CCc1ncnc(NCc2sc(C)nc2C)c1F
450186,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,20.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450187,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,20.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450188,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,30.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450189,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,60.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450190,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,20.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450191,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,45.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450192,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,60.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450193,CN(c1nccnc1)S(=O)(=O)c1cn(C2CCC2)nc1,294.10192,[M+H]+,20.0,val,CN(c1cnccn1)S(=O)(=O)c1cnn(C2CCC2)c1
450194,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450195,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450196,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,60.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450197,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,30.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450198,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450199,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,60.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450200,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,30.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450201,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,276.11021,[M-H]-,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450202,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,276.11021,[M-H]-,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450203,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,276.11021,[M-H]-,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450204,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,276.11021,[M-H]-,60.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450205,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,276.11021,[M-H]-,30.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450206,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,276.11021,[M-H]-,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450207,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C,278.12476,[M+H]+,20.0,val,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C
450208,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C,278.12476,[M+H]+,20.0,val,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C
450209,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C,278.12476,[M+H]+,60.0,val,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C
450210,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C,278.12476,[M+H]+,15.0,val,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C
450211,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C,278.12476,[M+H]+,20.0,val,CC1CN(C(=O)c2nccnc2C(N)=O)CC(=O)N1C
450212,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,278.12476,[M+H]+,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450213,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,278.12476,[M+H]+,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450214,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,278.12476,[M+H]+,60.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450215,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,278.12476,[M+H]+,30.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450216,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1,278.12476,[M+H]+,20.0,val,O=C(Cc1ccn[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1
450217,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,278.12476,[M+H]+,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450218,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,278.12476,[M+H]+,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450219,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,278.12476,[M+H]+,60.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450220,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,278.12476,[M+H]+,30.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450221,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1,278.12476,[M+H]+,20.0,val,O=C(NCc1nc(=O)[nH][nH]1)c1coc(C2CCCC2)n1
450222,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450223,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450224,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,60.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450225,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,30.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450226,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450227,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450228,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450229,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,60.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450230,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,30.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450231,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450232,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450233,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450234,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,60.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450235,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,30.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450236,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,276.11021,[M-H]-,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450237,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450238,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450239,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,60.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450240,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,30.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450241,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450242,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,60.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450243,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,30.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450244,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c1[nH]c(N)nc2=O,278.12476,[M+H]+,20.0,val,C=C1[C@H](CO)[C@@H](O)C[C@@H]1n1cnc2c(=O)nc(N)[nH]c21
450245,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450246,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450247,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450248,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,30.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450249,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450250,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450251,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,30.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450252,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,236.09283,[M-H]-,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450253,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,236.09283,[M-H]-,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450254,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,236.09283,[M-H]-,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450255,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,236.09283,[M-H]-,30.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450256,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,236.09283,[M-H]-,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450257,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450258,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450259,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,60.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450260,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,30.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450261,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450262,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,30.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450263,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,236.09283,[M-H]-,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450264,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450265,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450266,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,60.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450267,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,30.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450268,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450269,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,30.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450270,COC1(c2ncc(C(=O)O)cc2)CCOCC1,236.09283,[M-H]-,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450271,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450272,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450273,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,60.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450274,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,15.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450275,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450276,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,60.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450277,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,15.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450278,COC1(c2ncc(C(=O)O)cc2)CCOCC1,238.10738,[M+H]+,20.0,val,COC1(c2ccc(C(=O)O)cn2)CCOCC1
450279,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,220.09682,[M+H-H2O]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450280,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,220.09682,[M+H-H2O]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450281,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,220.09682,[M+H-H2O]+,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450282,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,220.09682,[M+H-H2O]+,15.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450283,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,220.09682,[M+H-H2O]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450284,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450285,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450286,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,15.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450287,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450288,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,30.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450289,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450290,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450291,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,238.10738,[M+H]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450292,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,260.08933,[M+Na]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450293,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,260.08933,[M+Na]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450294,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,260.08933,[M+Na]+,60.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450295,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,260.08933,[M+Na]+,30.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450296,Cc1c(C(=O)NC2CCC(C(=O)O)C2)occ1,260.08933,[M+Na]+,20.0,val,Cc1ccoc1C(=O)NC1CCC(C(=O)O)C1
450297,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450298,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450299,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450300,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450301,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450302,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450303,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450304,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,238.10738,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450305,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,260.08933,[M+Na]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450306,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,260.08933,[M+Na]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450307,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,260.08933,[M+Na]+,60.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450308,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,260.08933,[M+Na]+,30.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450309,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1,260.08933,[M+Na]+,20.0,val,Cc1ccc(C(=O)N2CCC(C)(C(=O)O)C2)o1
450310,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,220.09682,[M+H-H2O]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450311,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,220.09682,[M+H-H2O]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450312,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,220.09682,[M+H-H2O]+,60.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450313,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,220.09682,[M+H-H2O]+,30.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450314,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,220.09682,[M+H-H2O]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450315,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450316,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450317,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,60.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450318,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,15.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450319,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450320,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,60.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450321,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,15.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450322,Cc1c(C(=O)NC2(C(=O)O)CCCC2)cco1,238.10738,[M+H]+,20.0,val,Cc1occc1C(=O)NC1(C(=O)O)CCCC1
450323,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450324,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450325,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,60.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450326,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,30.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450327,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450328,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,60.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450329,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,30.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450330,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,236.09283,[M-H]-,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450331,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,238.10738,[M+H]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450332,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,238.10738,[M+H]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450333,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,238.10738,[M+H]+,60.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450334,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,238.10738,[M+H]+,15.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450335,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,238.10738,[M+H]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450336,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,260.08933,[M+Na]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450337,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,260.08933,[M+Na]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450338,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,260.08933,[M+Na]+,60.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450339,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,260.08933,[M+Na]+,30.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450340,CCOc1c(C(=O)OC)ccc(NC(C)=O)c1,260.08933,[M+Na]+,20.0,val,CCOc1cc(NC(C)=O)ccc1C(=O)OC
450341,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,236.09283,[M-H]-,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450342,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,236.09283,[M-H]-,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450343,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,236.09283,[M-H]-,60.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450344,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,236.09283,[M-H]-,30.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450345,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,236.09283,[M-H]-,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450346,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,238.10738,[M+H]+,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450347,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,238.10738,[M+H]+,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450348,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,238.10738,[M+H]+,60.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450349,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,238.10738,[M+H]+,15.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450350,COc1ccc(CC(NC(C)=O)C(=O)O)cc1,238.10738,[M+H]+,20.0,val,COc1ccc(CC(NC(C)=O)C(=O)O)cc1
450351,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450352,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450353,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,60.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450354,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,30.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450355,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450356,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450357,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,30.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450358,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,236.09283,[M-H]-,60.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450359,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,238.10738,[M+H]+,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450360,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,238.10738,[M+H]+,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450361,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,238.10738,[M+H]+,60.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450362,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,238.10738,[M+H]+,15.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450363,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,238.10738,[M+H]+,20.0,val,C[C@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
450364,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,20.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450365,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,20.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450366,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,60.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450367,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,30.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450368,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,20.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450369,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,60.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450370,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,30.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450371,CC(C(=O)O)N(C)S(=O)(=O)c1cc2c(cc1)OCC2,284.05982,[M-H]-,20.0,val,CC(C(=O)O)N(C)S(=O)(=O)c1ccc2c(c1)CCO2
450372,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450373,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450374,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,60.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450375,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,30.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450376,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450377,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,60.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450378,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,30.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450379,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1,284.05982,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(O)C2)c1
450380,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1,284.05982,[M-H]-,20.0,val,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1
450381,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1,284.05982,[M-H]-,20.0,val,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1
450382,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1,284.05982,[M-H]-,60.0,val,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1
450383,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1,284.05982,[M-H]-,15.0,val,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1
450384,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1,284.05982,[M-H]-,20.0,val,O=C(O)CC1COCCN1S(=O)(=O)c1ccccc1
450385,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,20.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450386,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,20.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450387,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,60.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450388,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,30.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450389,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,20.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450390,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,60.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450391,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,30.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450392,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O,284.05982,[M-H]-,20.0,val,CC(CNC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)O
450393,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,284.05982,[M-H]-,20.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450394,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,284.05982,[M-H]-,20.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450395,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,284.05982,[M-H]-,60.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450396,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,284.05982,[M-H]-,15.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450397,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,284.05982,[M-H]-,20.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450398,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,320.0365,[M+Cl]-,20.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450399,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,320.0365,[M+Cl]-,20.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450400,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12,320.0365,[M+Cl]-,30.0,val,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C([C@H]3CCCO3)S[C@H]12
450401,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,20.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450402,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,20.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450403,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,60.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450404,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,30.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450405,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,20.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450406,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,60.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450407,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,30.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450408,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1,330.04478,[M+H]+,20.0,val,Cn1cc(Br)c(C(=O)N2CCOC3(CCOC3)C2)n1
450409,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1,330.04478,[M+H]+,15.0,val,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1
450410,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1,330.04478,[M+H]+,15.0,val,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1
450411,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1,330.04478,[M+H]+,20.0,val,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1
450412,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1,330.04478,[M+H]+,60.0,val,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1
450413,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1,330.04478,[M+H]+,15.0,val,CCOC(=O)N1CCCC(Oc2ncc(Br)cn2)C1
450414,Brc1c2OCCOc2c(CNCC2CCOC2)s1,334.0107,[M+H]+,20.0,val,Brc1sc(CNCC2CCOC2)c2c1OCCO2
450415,Brc1c2OCCOc2c(CNCC2CCOC2)s1,334.0107,[M+H]+,20.0,val,Brc1sc(CNCC2CCOC2)c2c1OCCO2
450416,Brc1c2OCCOc2c(CNCC2CCOC2)s1,334.0107,[M+H]+,60.0,val,Brc1sc(CNCC2CCOC2)c2c1OCCO2
450417,Brc1c2OCCOc2c(CNCC2CCOC2)s1,334.0107,[M+H]+,15.0,val,Brc1sc(CNCC2CCOC2)c2c1OCCO2
450418,Brc1c2OCCOc2c(CNCC2CCOC2)s1,334.0107,[M+H]+,20.0,val,Brc1sc(CNCC2CCOC2)c2c1OCCO2
450419,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1,334.0107,[M+H]+,20.0,val,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1
450420,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1,334.0107,[M+H]+,20.0,val,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1
450421,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1,334.0107,[M+H]+,60.0,val,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1
450422,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1,334.0107,[M+H]+,30.0,val,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1
450423,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1,334.0107,[M+H]+,20.0,val,CCN(C)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1
450424,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450425,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450426,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,358.09237,[M+FA]-,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450427,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,358.09237,[M+FA]-,15.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450428,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450429,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450430,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450431,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450432,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450433,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,45.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450434,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450435,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450436,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc-21,314.10144,[M+H]+,45.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450437,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450438,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450439,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,358.09237,[M+FA]-,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450440,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,358.09237,[M+FA]-,15.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450441,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,358.09237,[M+FA]-,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450442,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450443,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450444,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,45.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450445,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450446,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450447,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,45.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450448,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,20.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450449,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2,314.10144,[M+H]+,60.0,val,OCC(O)Cn1cnc(Cl)c2nc(N3CCOCC3)nc1-2
450450,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450451,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450452,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450453,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450454,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450455,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450456,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450457,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450458,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,326.08886,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450459,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,326.08886,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450460,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,326.08886,[M+Cl]-,60.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450461,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1,326.08886,[M+Cl]-,15.0,val,CC(C)(C)OC(=O)N1CCc2c(C(F)(F)F)n[nH]c2C1
450462,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450463,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450464,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450465,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450466,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450467,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450468,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450469,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,290.11219,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450470,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,326.08886,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450471,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,326.08886,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450472,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,326.08886,[M+Cl]-,60.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450473,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,326.08886,[M+Cl]-,15.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450474,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,326.08886,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450475,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,336.11766,[M+FA]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450476,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,336.11766,[M+FA]-,20.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450477,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,336.11766,[M+FA]-,60.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450478,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1,336.11766,[M+FA]-,30.0,val,CC(C)(C)OC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1
450479,NCC1CC(=O)N(Cc2ccccc2)C1,205.13354,[M+H]+,20.0,val,NCC1CC(=O)N(Cc2ccccc2)C1
450480,NCC1CC(=O)N(Cc2ccccc2)C1,205.13354,[M+H]+,20.0,val,NCC1CC(=O)N(Cc2ccccc2)C1
450481,NCC1CC(=O)N(Cc2ccccc2)C1,205.13354,[M+H]+,60.0,val,NCC1CC(=O)N(Cc2ccccc2)C1
450482,NCC1CC(=O)N(Cc2ccccc2)C1,205.13354,[M+H]+,15.0,val,NCC1CC(=O)N(Cc2ccccc2)C1
450483,NCC1CC(=O)N(Cc2ccccc2)C1,205.13354,[M+H]+,20.0,val,NCC1CC(=O)N(Cc2ccccc2)C1
450484,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,205.13354,[M+H]+,20.0,val,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
450485,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,205.13354,[M+H]+,20.0,val,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
450486,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,205.13354,[M+H]+,60.0,val,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
450487,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,205.13354,[M+H]+,20.0,val,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
450488,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,205.13354,[M+H]+,45.0,val,CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
450489,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O,283.09356,[M-H]-,20.0,val,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O
450490,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O,283.09356,[M-H]-,20.0,val,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O
450491,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O,283.09356,[M-H]-,60.0,val,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O
450492,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O,283.09356,[M-H]-,30.0,val,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O
450493,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O,283.09356,[M-H]-,20.0,val,CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1ccc(=O)[nH]c1=O
450494,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O,265.12952,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O
450495,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O,265.12952,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O
450496,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O,265.12952,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O
450497,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O,265.12952,[M+H]+,30.0,val,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O
450498,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O,265.12952,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1CCC(=O)NC1=O
450499,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,295.06928,[M-H]-,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450500,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,295.06928,[M-H]-,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450501,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,295.06928,[M-H]-,60.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450502,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,295.06928,[M-H]-,30.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450503,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,295.06928,[M-H]-,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450504,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,297.08383,[M+H]+,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450505,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,297.08383,[M+H]+,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450506,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,297.08383,[M+H]+,60.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450507,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,297.08383,[M+H]+,15.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450508,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1,297.08383,[M+H]+,20.0,val,CCc1nnc(NC(=O)N(C)C(C)c2cccs2)s1
450509,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450510,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450511,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,60.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450512,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,30.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450513,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450514,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,60.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450515,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,30.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450516,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,291.10335,[M-H]-,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450517,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,293.11791,[M+H]+,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450518,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,293.11791,[M+H]+,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450519,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,293.11791,[M+H]+,60.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450520,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,293.11791,[M+H]+,30.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450521,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1n[nH]nn1,293.11791,[M+H]+,20.0,val,CC(C)C(NC(=O)c1csc(C2CC2)n1)c1nn[nH]n1
450522,C/C=C/c1cc(OC)c(OC)cc1OC,208.10994,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450523,C/C=C/c1cc(OC)c(OC)cc1OC,208.10994,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450524,C/C=C/c1cc(OC)c(OC)cc1OC,208.10994,[M]+,60.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450525,C/C=C/c1cc(OC)c(OC)cc1OC,208.10994,[M]+,30.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450526,C/C=C/c1cc(OC)c(OC)cc1OC,208.10994,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450527,C/C=C/c1cc(OC)c(OC)cc1OC,208.1094,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450528,C/C=C/c1cc(OC)c(OC)cc1OC,208.1094,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450529,C/C=C/c1cc(OC)c(OC)cc1OC,208.1094,[M]+,60.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450530,C/C=C/c1cc(OC)c(OC)cc1OC,208.1094,[M]+,30.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450531,C/C=C/c1cc(OC)c(OC)cc1OC,208.1094,[M]+,20.0,val,C/C=C/c1cc(OC)c(OC)cc1OC
450532,C[C@H](O)[C@H](O)/C=C/c1c(CO)c(O)ccc1,223.09758,[M-H]-,20.0,val,C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1CO
450533,C[C@H](O)[C@H](O)/C=C/c1c(CO)c(O)ccc1,223.09758,[M-H]-,20.0,val,C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1CO
450534,C[C@H](O)[C@H](O)/C=C/c1c(CO)c(O)ccc1,223.09758,[M-H]-,60.0,val,C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1CO
450535,C[C@H](O)[C@H](O)/C=C/c1c(CO)c(O)ccc1,223.09758,[M-H]-,30.0,val,C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1CO
450536,C[C@H](O)[C@H](O)/C=C/c1c(CO)c(O)ccc1,223.09758,[M-H]-,20.0,val,C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1CO
450537,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,30.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450538,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,30.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450539,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,20.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450540,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,60.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450541,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,30.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450542,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,20.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450543,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,30.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450544,CCCCCc1cc(O)cc(O)c1C(=O)O,223.09758,[M-H]-,60.0,val,CCCCCc1cc(O)cc(O)c1C(=O)O
450545,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,275.06917,[M+Cl]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450546,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,275.06917,[M+Cl]-,15.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450547,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,275.06917,[M+Cl]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450548,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450549,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450550,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,60.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450551,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,15.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450552,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450553,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,60.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450554,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,15.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450555,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O,285.09798,[M+FA]-,20.0,val,CC(C)(O)C1OC1C1=CC(=O)C2(C)OC2C1O
450556,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,218.12879,[M+H-H2O]+,30.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450557,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,218.12879,[M+H-H2O]+,30.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450558,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,218.12879,[M+H-H2O]+,20.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450559,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,218.12879,[M+H-H2O]+,60.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450560,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,218.12879,[M+H-H2O]+,30.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450561,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,236.13935,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450562,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,236.13935,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450563,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,236.13935,[M+H]+,60.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450564,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,236.13935,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450565,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1,236.13935,[M+H]+,45.0,val,Cc1cc(C)nc(N2CCC(C(=O)O)CC2)n1
450566,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450567,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450568,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450569,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,30.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450570,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450571,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450572,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,30.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450573,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,326.07509,[M-H]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450574,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,362.05177,[M+Cl]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450575,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,362.05177,[M+Cl]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450576,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,362.05177,[M+Cl]-,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450577,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,362.05177,[M+Cl]-,15.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450578,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,362.05177,[M+Cl]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450579,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,372.08057,[M+FA]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450580,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,372.08057,[M+FA]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450581,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,372.08057,[M+FA]-,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450582,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,372.08057,[M+FA]-,15.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450583,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,372.08057,[M+FA]-,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450584,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450585,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450586,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450587,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,30.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450588,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450589,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,60.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450590,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,30.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450591,COCCc1nsc(N[C@@H](C)CNC(=O)c2nscc2)n1,328.08964,[M+H]+,20.0,val,COCCc1nsc(N[C@@H](C)CNC(=O)c2ccsn2)n1
450592,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450593,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450594,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,30.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450595,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450596,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450597,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450598,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450599,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,314.05096,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450600,Brc1cnn(CC2CN(CC3COCCO3)C2)c1,316.06552,[M+H]+,20.0,val,Brc1cnn(CC2CN(CC3COCCO3)C2)c1
450601,Brc1cnn(CC2CN(CC3COCCO3)C2)c1,316.06552,[M+H]+,20.0,val,Brc1cnn(CC2CN(CC3COCCO3)C2)c1
450602,Brc1cnn(CC2CN(CC3COCCO3)C2)c1,316.06552,[M+H]+,45.0,val,Brc1cnn(CC2CN(CC3COCCO3)C2)c1
450603,Brc1cnn(CC2CN(CC3COCCO3)C2)c1,316.06552,[M+H]+,60.0,val,Brc1cnn(CC2CN(CC3COCCO3)C2)c1
450604,Brc1cnn(CC2CN(CC3COCCO3)C2)c1,316.06552,[M+H]+,20.0,val,Brc1cnn(CC2CN(CC3COCCO3)C2)c1
450605,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,316.06552,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450606,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,316.06552,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450607,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,316.06552,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450608,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,316.06552,[M+H]+,15.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450609,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1,316.06552,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(Br)[nH]1
450610,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,376.0715,[M+Cl]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450611,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,376.0715,[M+Cl]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450612,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,376.0715,[M+Cl]-,60.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450613,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,376.0715,[M+Cl]-,15.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450614,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,376.0715,[M+Cl]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450615,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450616,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450617,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,60.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450618,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,15.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450619,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450620,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,60.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450621,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,15.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450622,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,386.1003,[M+FA]-,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450623,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,20.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450624,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,20.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450625,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,60.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450626,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,15.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450627,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,20.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450628,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,60.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450629,CCNc1c(C(F)(F)F)cc(S(=O)(=O)N(C)CCOC)cn1,342.10937,[M+H]+,20.0,val,CCNc1ncc(S(=O)(=O)N(C)CCOC)cc1C(F)(F)F
450630,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,342.10937,[M+H]+,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450631,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,342.10937,[M+H]+,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450632,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,342.10937,[M+H]+,60.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450633,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,342.10937,[M+H]+,30.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450634,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C,342.10937,[M+H]+,20.0,val,Cc1c(S(=O)(=O)N2CCCC(O)(C(F)(F)F)CC2)cnn1C
450635,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450636,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450637,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450638,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,30.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450639,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450640,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450641,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,30.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450642,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,280.1166,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450643,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,326.12208,[M+FA]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450644,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,326.12208,[M+FA]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450645,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,326.12208,[M+FA]-,60.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450646,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,326.12208,[M+FA]-,15.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450647,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1,326.12208,[M+FA]-,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)C(F)(F)F)CC1
450648,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,20.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450649,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,20.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450650,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,45.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450651,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,60.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450652,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,20.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450653,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,45.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450654,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,60.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450655,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1,348.05674,[M+H]+,20.0,val,CC1CC(C)CN(C(=O)c2nn(C)cc2I)C1
450656,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,20.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450657,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,20.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450658,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,45.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450659,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,60.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450660,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,20.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450661,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,20.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450662,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,45.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450663,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1,315.09439,[M+H]+,60.0,val,Cc1nsc(N2CCOC(C(=O)N3CCSCC3)C2)n1
450664,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,316.07951,[M-H]-,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450665,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,316.07951,[M-H]-,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450666,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,316.07951,[M-H]-,60.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450667,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,316.07951,[M-H]-,15.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450668,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,316.07951,[M-H]-,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450669,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,318.09406,[M+H]+,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450670,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,318.09406,[M+H]+,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450671,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,318.09406,[M+H]+,60.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450672,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,318.09406,[M+H]+,30.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450673,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1,318.09406,[M+H]+,20.0,val,CCC(NC(=O)N1CCS(=O)(=O)CC1)c1nc(C)cs1
450674,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,300.0835,[M+H-H2O]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450675,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,300.0835,[M+H-H2O]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450676,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,300.0835,[M+H-H2O]+,60.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450677,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,300.0835,[M+H-H2O]+,30.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450678,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,300.0835,[M+H-H2O]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450679,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,318.09406,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450680,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,318.09406,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450681,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,318.09406,[M+H]+,60.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450682,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,318.09406,[M+H]+,15.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450683,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1,318.09406,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC1(O)CSCCSC1
450684,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450685,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450686,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,60.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450687,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,30.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450688,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450689,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,60.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450690,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,30.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450691,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,268.13028,[M-H]-,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450692,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,252.13427,[M+H-H2O]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450693,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,252.13427,[M+H-H2O]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450694,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,252.13427,[M+H-H2O]+,60.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450695,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,252.13427,[M+H-H2O]+,15.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450696,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,252.13427,[M+H-H2O]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450697,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,270.14483,[M+H]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450698,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,270.14483,[M+H]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450699,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,270.14483,[M+H]+,60.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450700,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,270.14483,[M+H]+,15.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450701,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1,270.14483,[M+H]+,20.0,val,O=C(CC1(O)CCCCC1)NCCc1nc(=O)o[nH]1
450702,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1,270.14483,[M+H]+,20.0,val,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1
450703,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1,270.14483,[M+H]+,20.0,val,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1
450704,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1,270.14483,[M+H]+,60.0,val,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1
450705,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1,270.14483,[M+H]+,15.0,val,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1
450706,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1,270.14483,[M+H]+,20.0,val,CO[C@H]1C[C@@H](C(N)=O)N(C(=O)C2CC(=O)N(C)C2)C1
450707,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O,268.13028,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O
450708,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O,268.13028,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O
450709,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O,268.13028,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O
450710,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O,268.13028,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O
450711,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O,268.13028,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)NC2=O
450712,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450713,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450714,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450715,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450716,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450717,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450718,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450719,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,342.11047,[M-H]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450720,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450721,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450722,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450723,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450724,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450725,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450726,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450727,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,378.08715,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450728,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450729,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450730,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450731,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,15.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450732,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450733,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450734,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,15.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450735,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,388.11595,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450736,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450737,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450738,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450739,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450740,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450741,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450742,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450743,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1,344.12502,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)N1CCS(=O)(=O)CC1
450744,CC(C)(O)CCCCCC1C=CC(=O)O1,195.13796,[M+H-H2O]+,15.0,val,CC(C)(O)CCCCCC1C=CC(=O)O1
450745,CC(C)(O)CCCCCC1C=CC(=O)O1,195.13796,[M+H-H2O]+,15.0,val,CC(C)(O)CCCCCC1C=CC(=O)O1
450746,CC(C)(O)CCCCCC1C=CC(=O)O1,195.13796,[M+H-H2O]+,20.0,val,CC(C)(O)CCCCCC1C=CC(=O)O1
450747,CC(C)(O)CCCCCC1C=CC(=O)O1,195.13796,[M+H-H2O]+,60.0,val,CC(C)(O)CCCCCC1C=CC(=O)O1
450748,CC(C)(O)CCCCCC1C=CC(=O)O1,195.13796,[M+H-H2O]+,15.0,val,CC(C)(O)CCCCCC1C=CC(=O)O1
450749,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,327.08522,[M+Cl]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450750,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,327.08522,[M+Cl]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450751,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,327.08522,[M+Cl]-,15.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450752,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,327.08522,[M+Cl]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450753,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,337.11402,[M+FA]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450754,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,337.11402,[M+FA]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450755,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,337.11402,[M+FA]-,60.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450756,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,337.11402,[M+FA]-,15.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450757,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,337.11402,[M+FA]-,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450758,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,293.12309,[M+H]+,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450759,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,293.12309,[M+H]+,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450760,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,310.14964,[M+NH4]+,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450761,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,310.14964,[M+NH4]+,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450762,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,310.14964,[M+NH4]+,60.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450763,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,310.14964,[M+NH4]+,15.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450764,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,310.14964,[M+NH4]+,20.0,val,CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450765,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,20.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450766,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,20.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450767,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,60.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450768,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,20.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450769,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,45.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450770,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,60.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450771,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,274.11185,[M-H]-,45.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450772,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1,276.1264,[M+H]+,20.0,val,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1
450773,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1,276.1264,[M+H]+,20.0,val,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1
450774,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1,276.1264,[M+H]+,60.0,val,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1
450775,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1,276.1264,[M+H]+,20.0,val,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1
450776,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1,276.1264,[M+H]+,45.0,val,CC1(C(=O)N2CCC(CS(C)(=O)=O)CC2)COC1
450777,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,276.1264,[M+H]+,15.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450778,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,276.1264,[M+H]+,15.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450779,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,276.1264,[M+H]+,60.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450780,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,276.1264,[M+H]+,20.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450781,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1,276.1264,[M+H]+,15.0,val,O=C(NS(=O)(=O)CC1CCCCO1)C1CCCC1
450782,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,20.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450783,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,20.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450784,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,60.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450785,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,30.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450786,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,20.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450787,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,60.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450788,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,30.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450789,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1,276.1264,[M+H]+,20.0,val,CO[C@@H]1CCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1
450790,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1,298.10835,[M+Na]+,20.0,val,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1
450791,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1,298.10835,[M+Na]+,20.0,val,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1
450792,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1,298.10835,[M+Na]+,30.0,val,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1
450793,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1,298.10835,[M+Na]+,20.0,val,CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCS1
450794,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,322.0966,[M-H]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450795,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,322.0966,[M-H]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450796,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,322.0966,[M-H]-,60.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450797,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,322.0966,[M-H]-,30.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450798,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,322.0966,[M-H]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450799,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,368.10208,[M+FA]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450800,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,368.10208,[M+FA]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450801,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,368.10208,[M+FA]-,60.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450802,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,368.10208,[M+FA]-,15.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450803,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,368.10208,[M+FA]-,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450804,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,324.11115,[M+H]+,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450805,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,324.11115,[M+H]+,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450806,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,324.11115,[M+H]+,60.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450807,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,324.11115,[M+H]+,15.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450808,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,324.11115,[M+H]+,20.0,val,CS/C=C/C(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
450809,CCC(C)OC(=O)N1CCCCC1CCO,230.17507,[M+H]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450810,CCC(C)OC(=O)N1CCCCC1CCO,230.17507,[M+H]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450811,CCC(C)OC(=O)N1CCCCC1CCO,230.17507,[M+H]+,60.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450812,CCC(C)OC(=O)N1CCCCC1CCO,230.17507,[M+H]+,15.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450813,CCC(C)OC(=O)N1CCCCC1CCO,230.17507,[M+H]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450814,CCC(C)OC(=O)N1CCCCC1CCO,252.15701,[M+Na]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450815,CCC(C)OC(=O)N1CCCCC1CCO,252.15701,[M+Na]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450816,CCC(C)OC(=O)N1CCCCC1CCO,252.15701,[M+Na]+,60.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450817,CCC(C)OC(=O)N1CCCCC1CCO,252.15701,[M+Na]+,30.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450818,CCC(C)OC(=O)N1CCCCC1CCO,252.15701,[M+Na]+,20.0,val,CCC(C)OC(=O)N1CCCCC1CCO
450819,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,20.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450820,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,20.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450821,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,60.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450822,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,30.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450823,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,20.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450824,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,30.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450825,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,20.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450826,CC1(CNC(=O)OC(C)(C)C)CCNCC1,229.19105,[M+H]+,60.0,val,CC1(CNC(=O)OC(C)(C)C)CCNCC1
450827,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,267.01422,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450828,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,267.01422,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450829,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,267.01422,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450830,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,267.01422,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450831,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,267.01422,[M-H]-,45.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450832,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,45.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450833,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,45.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450834,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450835,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450836,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,45.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450837,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450838,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450839,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450840,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450841,O=C(Nc1cnc(Cl)cc1)c1cc(F)c(F)cc1,269.02877,[M+H]+,45.0,val,O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(F)c1
450842,N#Cc1c(Cl)ccc(NS(=O)(=O)c2ccc(C(=O)O)s2)c1,340.9463,[M-H]-,20.0,val,N#Cc1cc(NS(=O)(=O)c2ccc(C(=O)O)s2)ccc1Cl
450843,N#Cc1c(Cl)ccc(NS(=O)(=O)c2ccc(C(=O)O)s2)c1,340.9463,[M-H]-,20.0,val,N#Cc1cc(NS(=O)(=O)c2ccc(C(=O)O)s2)ccc1Cl
450844,N#Cc1c(Cl)ccc(NS(=O)(=O)c2ccc(C(=O)O)s2)c1,340.9463,[M-H]-,60.0,val,N#Cc1cc(NS(=O)(=O)c2ccc(C(=O)O)s2)ccc1Cl
450845,N#Cc1c(Cl)ccc(NS(=O)(=O)c2ccc(C(=O)O)s2)c1,340.9463,[M-H]-,20.0,val,N#Cc1cc(NS(=O)(=O)c2ccc(C(=O)O)s2)ccc1Cl
450846,N#Cc1c(Cl)ccc(NS(=O)(=O)c2ccc(C(=O)O)s2)c1,340.9463,[M-H]-,45.0,val,N#Cc1cc(NS(=O)(=O)c2ccc(C(=O)O)s2)ccc1Cl
450847,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450848,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450849,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,45.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450850,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,60.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450851,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450852,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,60.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450853,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,45.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450854,Ic1ccc2[nH]c3ccc(I)cc3c2c1,417.85952,[M-H]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450855,Ic1ccc2[nH]c3ccc(I)cc3c2c1,453.8362,[M+Cl]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450856,Ic1ccc2[nH]c3ccc(I)cc3c2c1,453.8362,[M+Cl]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450857,Ic1ccc2[nH]c3ccc(I)cc3c2c1,453.8362,[M+Cl]-,60.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450858,Ic1ccc2[nH]c3ccc(I)cc3c2c1,453.8362,[M+Cl]-,15.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450859,Ic1ccc2[nH]c3ccc(I)cc3c2c1,453.8362,[M+Cl]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450860,Ic1ccc2[nH]c3ccc(I)cc3c2c1,463.865,[M+FA]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450861,Ic1ccc2[nH]c3ccc(I)cc3c2c1,463.865,[M+FA]-,20.0,val,Ic1ccc2[nH]c3ccc(I)cc3c2c1
450862,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,20.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450863,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,20.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450864,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,60.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450865,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,30.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450866,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,20.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450867,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,30.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450868,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,20.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450869,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl,310.95813,[M+H]+,60.0,val,O=C(Nc1ccccn1)c1cc(Br)ccc1Cl
450870,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,20.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450871,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,20.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450872,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,60.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450873,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,20.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450874,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,45.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450875,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,60.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450876,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,20.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450877,N#Cc1cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)cc(Br)c1,400.91163,[M-H]-,45.0,val,N#Cc1cc(Br)cc(S(=O)(=O)NC(=O)Cn2cc(Cl)cn2)c1
450878,O=C1CSC(c2c(Cl)cc(Cl)cc2)N1c1nccs1,330.95279,[M+H]+,20.0,val,O=C1CSC(c2ccc(Cl)cc2Cl)N1c1nccs1
450879,O=C1CSC(c2c(Cl)cc(Cl)cc2)N1c1nccs1,330.95279,[M+H]+,20.0,val,O=C1CSC(c2ccc(Cl)cc2Cl)N1c1nccs1
450880,O=C1CSC(c2c(Cl)cc(Cl)cc2)N1c1nccs1,330.95279,[M+H]+,30.0,val,O=C1CSC(c2ccc(Cl)cc2Cl)N1c1nccs1
450881,O=C1CSC(c2c(Cl)cc(Cl)cc2)N1c1nccs1,330.95279,[M+H]+,20.0,val,O=C1CSC(c2ccc(Cl)cc2Cl)N1c1nccs1
450882,O=C1CSC(c2c(Cl)cc(Cl)cc2)N1c1nccs1,330.95279,[M+H]+,20.0,val,O=C1CSC(c2ccc(Cl)cc2Cl)N1c1nccs1
450883,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,20.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450884,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,20.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450885,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,60.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450886,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,30.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450887,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,20.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450888,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,30.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450889,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,20.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450890,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl,308.99516,[M-H]-,60.0,val,N#Cc1cn[nH]c1NC(=O)COc1ccc(Cl)cc1Cl
450891,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450892,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450893,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,322.94954,[M-H]-,60.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450894,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,322.94954,[M-H]-,30.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450895,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450896,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450897,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450898,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450899,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,324.96409,[M+H]+,45.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450900,CCOc1c(Br)ccc2c1sc1c2c(=O)[nH]cn1,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450901,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450902,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450903,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,322.94954,[M-H]-,45.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450904,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,322.94954,[M-H]-,60.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450905,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,322.94954,[M-H]-,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450906,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450907,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450908,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,324.96409,[M+H]+,45.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450909,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,324.96409,[M+H]+,60.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450910,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12,324.96409,[M+H]+,20.0,val,CCOc1c(Br)ccc2c1sc1nc[nH]c(=O)c12
450911,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,280.00499,[M-H]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450912,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,280.00499,[M-H]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450913,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,280.00499,[M-H]-,60.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450914,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,280.00499,[M-H]-,15.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450915,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,280.00499,[M-H]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450916,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,315.98167,[M+Cl]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450917,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,315.98167,[M+Cl]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450918,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,315.98167,[M+Cl]-,60.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450919,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,315.98167,[M+Cl]-,15.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450920,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,315.98167,[M+Cl]-,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450921,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,282.01954,[M+H]+,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450922,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,282.01954,[M+H]+,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450923,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,282.01954,[M+H]+,60.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450924,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,282.01954,[M+H]+,30.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450925,O=C(Nc1cnccc1)Nc1c(Cl)ccc(Cl)c1,282.01954,[M+H]+,20.0,val,O=C(Nc1cccnc1)Nc1cc(Cl)ccc1Cl
450926,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12,299.98359,[M-H]-,20.0,val,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
450927,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12,299.98359,[M-H]-,20.0,val,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
450928,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12,299.98359,[M-H]-,60.0,val,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
450929,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12,299.98359,[M-H]-,15.0,val,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
450930,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12,299.98359,[M-H]-,20.0,val,O=C(O)CCc1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
450931,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,319.01743,[M-H]-,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450932,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,319.01743,[M-H]-,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450933,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,319.01743,[M-H]-,60.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450934,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,319.01743,[M-H]-,30.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450935,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,319.01743,[M-H]-,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450936,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,321.03198,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450937,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,321.03198,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450938,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,321.03198,[M+H]+,60.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450939,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,321.03198,[M+H]+,15.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450940,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1,321.03198,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Cl)cc1)Nc1nccs1
450941,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450942,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450943,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,60.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450944,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,15.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450945,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450946,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450947,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450948,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,60.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450949,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,30.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450950,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450951,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450952,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450953,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,60.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450954,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,15.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450955,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,274.04694,[M-H]-,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450956,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450957,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450958,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,60.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450959,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,30.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450960,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1,276.0615,[M+H]+,20.0,val,O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(O)cc1
450961,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450962,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450963,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,45.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450964,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,60.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450965,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450966,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450967,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,45.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450968,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,310.98181,[M-H]-,60.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450969,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,346.95849,[M+Cl]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450970,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,346.95849,[M+Cl]-,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450971,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,346.95849,[M+Cl]-,60.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450972,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,20.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450973,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,20.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450974,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,60.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450975,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,30.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450976,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,20.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450977,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,30.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450978,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,60.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450979,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl,312.99636,[M+H]+,20.0,val,Cc1ccsc1C(=O)N/N=C/c1c(Cl)cccc1Cl
450980,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl,312.99636,[M+H]+,20.0,val,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl
450981,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl,312.99636,[M+H]+,20.0,val,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl
450982,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl,312.99636,[M+H]+,60.0,val,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl
450983,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl,312.99636,[M+H]+,30.0,val,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl
450984,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl,312.99636,[M+H]+,20.0,val,C/C(=N\NC(=O)c1cccs1)c1cc(Cl)ccc1Cl
450985,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,312.99636,[M+H]+,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450986,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,312.99636,[M+H]+,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450987,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,312.99636,[M+H]+,60.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450988,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,312.99636,[M+H]+,30.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450989,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1,312.99636,[M+H]+,20.0,val,O=C(Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1
450990,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450991,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450992,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,60.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450993,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,15.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450994,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450995,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,60.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450996,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,15.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450997,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,241.06187,[M-H]-,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
450998,O=C(O)c1ccccc1C(=O)Nc1ccccn1,241.06187,[M-H]-,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
450999,O=C(O)c1ccccc1C(=O)Nc1ccccn1,241.06187,[M-H]-,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451000,O=C(O)c1ccccc1C(=O)Nc1ccccn1,241.06187,[M-H]-,60.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451001,O=C(O)c1ccccc1C(=O)Nc1ccccn1,241.06187,[M-H]-,15.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451002,O=C(O)c1ccccc1C(=O)Nc1ccccn1,241.06187,[M-H]-,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451003,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451004,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451005,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,60.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451006,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,30.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451007,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451008,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,60.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451009,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,30.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451010,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,241.06187,[M-H]-,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451011,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,241.06187,[M-H]-,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451012,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,241.06187,[M-H]-,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451013,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,241.06187,[M-H]-,60.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451014,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,241.06187,[M-H]-,30.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451015,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,241.06187,[M-H]-,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451016,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,241.06187,[M-H]-,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451017,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,241.06187,[M-H]-,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451018,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,241.06187,[M-H]-,60.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451019,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,241.06187,[M-H]-,15.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451020,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,241.06187,[M-H]-,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451021,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451022,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451023,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,60.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451024,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,30.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451025,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451026,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,60.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451027,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,30.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451028,O=C(Nc1c(C(=O)O)ccnc1)c1ccccc1,243.07642,[M+H]+,20.0,val,O=C(Nc1cnccc1C(=O)O)c1ccccc1
451029,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451030,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451031,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,60.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451032,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,30.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451033,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451034,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,60.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451035,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,30.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451036,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccc(NC(=O)c2ccccn2)cc1
451037,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,225.06586,[M+H-H2O]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451038,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,225.06586,[M+H-H2O]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451039,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,225.06586,[M+H-H2O]+,60.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451040,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,225.06586,[M+H-H2O]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451041,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,225.06586,[M+H-H2O]+,45.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451042,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451043,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451044,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451045,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,30.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451046,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451047,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,60.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451048,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,30.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451049,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1,243.07642,[M+H]+,20.0,val,Cn1cc(C(=O)O)c(-c2coc3ccccc23)n1
451050,O=C(O)c1ccccc1C(=O)Nc1ccccn1,225.06586,[M+H-H2O]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451051,O=C(O)c1ccccc1C(=O)Nc1ccccn1,225.06586,[M+H-H2O]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451052,O=C(O)c1ccccc1C(=O)Nc1ccccn1,225.06586,[M+H-H2O]+,60.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451053,O=C(O)c1ccccc1C(=O)Nc1ccccn1,225.06586,[M+H-H2O]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451054,O=C(O)c1ccccc1C(=O)Nc1ccccn1,225.06586,[M+H-H2O]+,45.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451055,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451056,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451057,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,60.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451058,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,30.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451059,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451060,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,60.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451061,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,30.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451062,O=C(O)c1ccccc1C(=O)Nc1ccccn1,243.07642,[M+H]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451063,O=C(O)c1ccccc1C(=O)Nc1ccccn1,265.05836,[M+Na]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451064,O=C(O)c1ccccc1C(=O)Nc1ccccn1,265.05836,[M+Na]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451065,O=C(O)c1ccccc1C(=O)Nc1ccccn1,265.05836,[M+Na]+,60.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451066,O=C(O)c1ccccc1C(=O)Nc1ccccn1,265.05836,[M+Na]+,15.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451067,O=C(O)c1ccccc1C(=O)Nc1ccccn1,265.05836,[M+Na]+,20.0,val,O=C(O)c1ccccc1C(=O)Nc1ccccn1
451068,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451069,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451070,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,60.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451071,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,30.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451072,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451073,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,60.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451074,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,30.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451075,O=C(O)c1c(Cn2cccn2)c2ccccc2o1,243.07642,[M+H]+,20.0,val,O=C(O)c1oc2ccccc2c1Cn1cccn1
451076,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451077,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451078,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,60.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451079,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,30.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451080,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451081,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,60.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451082,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,30.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451083,O=C(O)c1cc(NC(=O)c2cnccc2)ccc1,243.07642,[M+H]+,20.0,val,O=C(O)c1cccc(NC(=O)c2cccnc2)c1
451084,S=C(Nc1ccccc1)Nc1ccccc1Br,304.97536,[M-H]-,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451085,S=C(Nc1ccccc1)Nc1ccccc1Br,304.97536,[M-H]-,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451086,S=C(Nc1ccccc1)Nc1ccccc1Br,304.97536,[M-H]-,60.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451087,S=C(Nc1ccccc1)Nc1ccccc1Br,304.97536,[M-H]-,15.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451088,S=C(Nc1ccccc1)Nc1ccccc1Br,304.97536,[M-H]-,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451089,S=C(Nc1ccccc1)Nc1ccccc1Br,306.98991,[M+H]+,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451090,S=C(Nc1ccccc1)Nc1ccccc1Br,306.98991,[M+H]+,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451091,S=C(Nc1ccccc1)Nc1ccccc1Br,306.98991,[M+H]+,60.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451092,S=C(Nc1ccccc1)Nc1ccccc1Br,306.98991,[M+H]+,30.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451093,S=C(Nc1ccccc1)Nc1ccccc1Br,306.98991,[M+H]+,20.0,val,S=C(Nc1ccccc1)Nc1ccccc1Br
451094,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,316.047,[M-H]-,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451095,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,316.047,[M-H]-,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451096,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,316.047,[M-H]-,60.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451097,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,316.047,[M-H]-,15.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451098,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,316.047,[M-H]-,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451099,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C,318.06155,[M+H]+,20.0,val,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C
451100,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C,318.06155,[M+H]+,20.0,val,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C
451101,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C,318.06155,[M+H]+,30.0,val,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C
451102,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C,318.06155,[M+H]+,60.0,val,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C
451103,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C,318.06155,[M+H]+,20.0,val,Cc1c(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1C
451104,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451105,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451106,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,60.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451107,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,30.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451108,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451109,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,60.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451110,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,30.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451111,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F,318.06155,[M+H]+,20.0,val,OC(CNc1ncc(Cl)cn1)(c1ccccc1)C(F)(F)F
451112,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1,308.99286,[M-H]-,30.0,val,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1
451113,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1,308.99286,[M-H]-,30.0,val,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1
451114,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1,308.99286,[M-H]-,20.0,val,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1
451115,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1,308.99286,[M-H]-,60.0,val,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1
451116,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1,308.99286,[M-H]-,30.0,val,O=C(NC(=S)NCc1cccs1)c1ccc(Cl)cc1
451117,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,20.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451118,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,20.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451119,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,60.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451120,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,30.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451121,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,20.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451122,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,60.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451123,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,30.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451124,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1,319.05272,[M+H]+,20.0,val,Clc1cnc(NC2CN(c3ncnc4ccsc34)C2)nc1
451125,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451126,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451127,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,60.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451128,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,30.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451129,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451130,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,30.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451131,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451132,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,319.99915,[M-H]-,60.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451133,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,322.0137,[M+H]+,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451134,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,322.0137,[M+H]+,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451135,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,322.0137,[M+H]+,60.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451136,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,322.0137,[M+H]+,15.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451137,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1,322.0137,[M+H]+,20.0,val,Cc1csc(SCC(=O)Nc2nc3ccccc3s2)n1
451138,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451139,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451140,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451141,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,30.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451142,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451143,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451144,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,30.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451145,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451146,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451147,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451148,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451149,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451150,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,45.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451151,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451152,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451153,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451154,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,30.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451155,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451156,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451157,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,30.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451158,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,312.0673,[M-H]-,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451159,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451160,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451161,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,45.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451162,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451163,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451164,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,60.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451165,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,45.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451166,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1,314.08186,[M+H]+,20.0,val,CCn1c(Sc2ncc(C#N)c(N)n2)nnc1-c1ccco1
451167,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl,315.02977,[M+H]+,20.0,val,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl
451168,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl,315.02977,[M+H]+,20.0,val,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl
451169,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl,315.02977,[M+H]+,60.0,val,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl
451170,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl,315.02977,[M+H]+,30.0,val,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl
451171,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl,315.02977,[M+H]+,20.0,val,COC(=O)C1=C(C)NC(=O)NC1c1c(Cl)cccc1Cl
451172,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl,311.04609,[M+H]+,20.0,val,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl
451173,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl,311.04609,[M+H]+,20.0,val,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl
451174,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl,311.04609,[M+H]+,60.0,val,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl
451175,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl,311.04609,[M+H]+,30.0,val,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl
451176,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl,311.04609,[M+H]+,20.0,val,Cc1nn(C)cc1/C=N/NC(=O)c1cc(Cl)ccc1Cl
451177,O=C1CSC(N2CCN(c3cc(Cl)c(Cl)cc3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451178,O=C1CSC(N2CCN(c3cc(Cl)c(Cl)cc3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451179,O=C1CSC(N2CCN(c3cc(Cl)c(Cl)cc3)CC2)=N1,330.02291,[M+H]+,60.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451180,O=C1CSC(N2CCN(c3cc(Cl)c(Cl)cc3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451181,O=C1CSC(N2CCN(c3cc(Cl)c(Cl)cc3)CC2)=N1,330.02291,[M+H]+,45.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451182,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl,328.00836,[M-H]-,20.0,val,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl
451183,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl,328.00836,[M-H]-,20.0,val,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl
451184,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl,328.00836,[M-H]-,60.0,val,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl
451185,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl,328.00836,[M-H]-,15.0,val,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl
451186,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl,328.00836,[M-H]-,20.0,val,CNC(=O)C1=C(C)NC(=S)NC1c1ccc(Cl)cc1Cl
451187,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451188,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451189,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,45.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451190,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,60.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451191,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451192,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,60.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451193,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,45.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451194,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1,330.02291,[M+H]+,20.0,val,O=C1CSC(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=N1
451195,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451196,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451197,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,60.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451198,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,30.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451199,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451200,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,60.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451201,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,30.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451202,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)O
451203,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451204,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451205,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,60.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451206,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,30.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451207,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451208,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,60.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451209,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,30.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451210,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O,265.07383,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)O
451211,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,20.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451212,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,20.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451213,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,60.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451214,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,30.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451215,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,20.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451216,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,60.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451217,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,30.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451218,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O,327.02118,[M-H]-,20.0,val,C[C@H]1CN(S(=O)(=O)c2ccc(C#N)c(Cl)c2)C[C@@H]1C(=O)O
451219,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451220,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451221,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,45.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451222,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451223,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451224,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,45.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451225,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451226,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1,327.02118,[M-H]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(Cl)nc2)c1
451227,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl,327.02118,[M-H]-,20.0,val,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl
451228,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl,327.02118,[M-H]-,20.0,val,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl
451229,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl,327.02118,[M-H]-,60.0,val,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl
451230,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl,327.02118,[M-H]-,30.0,val,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl
451231,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl,327.02118,[M-H]-,20.0,val,CC1=NS(=O)(=O)N(C)C=C1C(=O)OCc1ccccc1Cl
451232,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451233,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451234,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,60.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451235,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,30.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451236,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451237,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,60.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451238,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,30.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451239,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,344.05221,[M-H]-,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451240,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451241,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451242,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,60.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451243,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,30.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451244,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451245,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,60.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451246,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,30.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451247,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,344.05221,[M-H]-,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451248,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,344.05221,[M-H]-,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451249,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,344.05221,[M-H]-,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451250,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,344.05221,[M-H]-,60.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451251,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,344.05221,[M-H]-,15.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451252,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,344.05221,[M-H]-,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451253,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451254,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451255,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,30.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451256,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,60.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451257,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,15.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451258,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451259,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1,346.06676,[M+H]+,20.0,val,CN(C(C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1cn(C)cn1
451260,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,346.06676,[M+H]+,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451261,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,346.06676,[M+H]+,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451262,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,346.06676,[M+H]+,60.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451263,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,346.06676,[M+H]+,20.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451264,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3c2cccn3)CCC1(F)F,346.06676,[M+H]+,45.0,val,O=C(O)C1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCC1(F)F
451265,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,346.06676,[M+H]+,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451266,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,346.06676,[M+H]+,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451267,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,346.06676,[M+H]+,60.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451268,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,346.06676,[M+H]+,30.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451269,Cn1cc(CC(NS(=O)(=O)c2c(F)cc(F)cc2)C(=O)O)cn1,346.06676,[M+H]+,20.0,val,Cn1cc(CC(NS(=O)(=O)c2ccc(F)cc2F)C(=O)O)cn1
451270,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,322.05032,[M-H]-,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451271,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,322.05032,[M-H]-,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451272,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,322.05032,[M-H]-,45.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451273,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,322.05032,[M-H]-,60.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451274,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,322.05032,[M-H]-,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451275,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,324.06487,[M+H]+,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451276,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,324.06487,[M+H]+,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451277,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,324.06487,[M+H]+,60.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451278,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,324.06487,[M+H]+,30.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451279,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O,324.06487,[M+H]+,20.0,val,COc1coc(C(=O)Nc2nnc(C3CCCO3)s2)cc1=O
451280,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451281,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451282,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451283,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451284,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,15.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451285,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451286,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451287,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451288,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451289,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451290,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451291,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451292,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451293,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451294,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451295,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451296,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451297,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451298,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451299,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451300,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,354.02239,[M-H]-,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451301,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451302,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451303,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451304,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451305,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451306,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,60.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451307,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,30.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451308,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,356.03694,[M+H]+,20.0,val,O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
451309,Cc1nc(CSc2c3c(C)c(C)sc3ncn2)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451310,Cc1nc(CSc2c3c(C)c(C)sc3ncn2)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451311,Cc1nc(CSc2c3c(C)c(C)sc3ncn2)cs1,308.03444,[M+H]+,60.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451312,Cc1nc(CSc2c3c(C)c(C)sc3ncn2)cs1,308.03444,[M+H]+,30.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451313,Cc1nc(CSc2c3c(C)c(C)sc3ncn2)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451314,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451315,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451316,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1,308.03444,[M+H]+,60.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451317,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1,308.03444,[M+H]+,30.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451318,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1,308.03444,[M+H]+,20.0,val,Cc1nc(CSc2ncnc3sc(C)c(C)c23)cs1
451319,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,302.07172,[M-H]-,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451320,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,302.07172,[M-H]-,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451321,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,302.07172,[M-H]-,60.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451322,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,302.07172,[M-H]-,30.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451323,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,302.07172,[M-H]-,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451324,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,304.08627,[M+H]+,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451325,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,304.08627,[M+H]+,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451326,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,304.08627,[M+H]+,60.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451327,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,304.08627,[M+H]+,30.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451328,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1,304.08627,[M+H]+,20.0,val,CC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1
451329,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451330,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451331,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451332,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451333,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451334,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451335,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451336,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451337,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451338,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451339,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,373.03391,[M+Cl]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451340,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,373.03391,[M+Cl]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451341,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451342,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451343,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451344,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,339.07178,[M+H]+,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451345,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,339.07178,[M+H]+,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451346,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2c(cc(Cl)cc2)O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451347,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451348,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451349,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451350,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451351,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451352,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451353,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451354,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,337.05723,[M-H]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451355,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451356,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451357,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451358,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451359,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451360,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451361,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,15.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451362,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,373.03391,[M+Cl]-,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451363,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451364,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451365,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,339.07178,[M+H]+,60.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451366,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,339.07178,[M+H]+,30.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451367,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1,339.07178,[M+H]+,20.0,val,CCC(C)NC(=O)NC1(C(F)(F)F)Oc2ccc(Cl)cc2O1
451368,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,299.06042,[M-H]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451369,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,299.06042,[M-H]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451370,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,299.06042,[M-H]-,60.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451371,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,299.06042,[M-H]-,30.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451372,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,299.06042,[M-H]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451373,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,335.0371,[M+Cl]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451374,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,335.0371,[M+Cl]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451375,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,335.0371,[M+Cl]-,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451376,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451377,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451378,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,60.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451379,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,30.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451380,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451381,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,60.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451382,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,30.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451383,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1ccc(F)cc1Cl
451384,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl
451385,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl
451386,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl,301.07497,[M+H]+,60.0,val,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl
451387,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl,301.07497,[M+H]+,30.0,val,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl
451388,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl,301.07497,[M+H]+,20.0,val,O=C(O)CC1C(=O)NCCN1Cc1c(F)cccc1Cl
451389,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,20.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451390,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,20.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451391,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,60.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451392,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,30.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451393,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,20.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451394,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,60.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451395,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,30.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451396,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1,264.08982,[M+H]+,20.0,val,Clc1ccc(-c2noc(C3CCNCC3)n2)cc1
451397,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O,308.09088,[M+H]+,20.0,val,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O
451398,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O,308.09088,[M+H]+,20.0,val,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O
451399,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O,308.09088,[M+H]+,30.0,val,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O
451400,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O,308.09088,[M+H]+,60.0,val,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O
451401,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O,308.09088,[M+H]+,20.0,val,Cn1nc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)ccc1=O
451402,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451403,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451404,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451405,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,30.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451406,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451407,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451408,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,30.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451409,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,306.05857,[M-H]-,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451410,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451411,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451412,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451413,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,15.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451414,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451415,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,15.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451416,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451417,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,352.06405,[M+FA]-,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451418,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451419,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451420,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451421,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,30.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451422,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451423,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,20.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451424,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,60.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451425,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N,308.07312,[M+H]+,30.0,val,CCn1c(CNc2ccc(Cl)cc2)nnc1SCC#N
451426,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1,318.106,[M+H]+,20.0,val,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1
451427,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1,318.106,[M+H]+,20.0,val,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1
451428,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1,318.106,[M+H]+,60.0,val,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1
451429,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1,318.106,[M+H]+,20.0,val,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1
451430,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1,318.106,[M+H]+,45.0,val,O=C1CCC2CN(C(=O)c3coc(C(F)(F)F)n3)CCC2N1
451431,Cc1cc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)ccc1,336.05229,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)c1
451432,Cc1cc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)ccc1,336.05229,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)c1
451433,Cc1cc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)ccc1,336.05229,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)c1
451434,Cc1cc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)ccc1,336.05229,[M-H]-,15.0,val,Cc1cccc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)c1
451435,Cc1cc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)ccc1,336.05229,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)N2CCC(C(=O)O)(C(F)(F)F)C2)c1
451436,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451437,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451438,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,60.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451439,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,15.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451440,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451441,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,60.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451442,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,15.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451443,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,336.05229,[M-H]-,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451444,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,338.06684,[M+H]+,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451445,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,338.06684,[M+H]+,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451446,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,338.06684,[M+H]+,60.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451447,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,338.06684,[M+H]+,15.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451448,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1,338.06684,[M+H]+,20.0,val,O=C(O)CC1CCCN1S(=O)(=O)c1cccc(C(F)(F)F)c1
451449,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451450,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451451,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,60.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451452,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,30.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451453,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451454,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,60.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451455,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,30.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451456,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,262.09973,[M-H]-,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451457,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451458,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451459,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,60.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451460,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,30.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451461,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451462,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,60.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451463,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,30.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451464,O=C(O)C1CCCN1Cc1nc2c(cccc2F)[nH]1,264.11428,[M+H]+,20.0,val,O=C(O)C1CCCN1Cc1nc2c(F)cccc2[nH]1
451465,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451466,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451467,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,60.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451468,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,30.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451469,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451470,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451471,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,30.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451472,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,326.06163,[M-H]-,60.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451473,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,326.06163,[M-H]-,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451474,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,326.06163,[M-H]-,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451475,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,326.06163,[M-H]-,60.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451476,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,326.06163,[M-H]-,30.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451477,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,326.06163,[M-H]-,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451478,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,328.07618,[M+H]+,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451479,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,328.07618,[M+H]+,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451480,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,328.07618,[M+H]+,60.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451481,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,328.07618,[M+H]+,30.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451482,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O,328.07618,[M+H]+,20.0,val,COc1ccc(F)cc1S(=O)(=O)NCCn1ncccc1=O
451483,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451484,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451485,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,60.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451486,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,30.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451487,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451488,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,30.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451489,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,60.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451490,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1,328.07618,[M+H]+,20.0,val,COc1ncc(NS(=O)(=O)Cc2ccccc2F)c(OC)n1
451491,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451492,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,60.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451493,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451494,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,45.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451495,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,60.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451496,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451497,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,245.07541,[M-H]-,45.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451498,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451499,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451500,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,30.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451501,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,60.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451502,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451503,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,45.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451504,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,60.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451505,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,247.08996,[M+H]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451506,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,269.0719,[M+Na]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451507,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,269.0719,[M+Na]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451508,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,269.0719,[M+Na]+,60.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451509,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,269.0719,[M+Na]+,30.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451510,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1,269.0719,[M+Na]+,20.0,val,CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1
451511,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3,323.06309,[M+H]+,20.0,val,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3
451512,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3,323.06309,[M+H]+,20.0,val,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3
451513,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3,323.06309,[M+H]+,60.0,val,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3
451514,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3,323.06309,[M+H]+,15.0,val,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3
451515,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3,323.06309,[M+H]+,20.0,val,NC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3
451516,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,305.07139,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451517,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,305.07139,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451518,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,305.07139,[M-H]-,60.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451519,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,305.07139,[M-H]-,15.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451520,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,305.07139,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451521,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451522,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451523,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,60.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451524,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,30.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451525,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451526,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,30.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451527,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,60.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451528,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,305.07139,[M-H]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451529,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451530,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451531,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,60.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451532,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451533,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,60.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451534,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,341.04806,[M+Cl]-,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451535,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451536,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451537,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,60.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451538,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,30.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451539,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451540,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,30.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451541,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451542,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,305.07139,[M-H]-,60.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451543,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,307.08594,[M+H]+,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451544,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,307.08594,[M+H]+,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451545,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,307.08594,[M+H]+,60.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451546,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,307.08594,[M+H]+,15.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451547,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1,307.08594,[M+H]+,20.0,val,COc1cccc(NC(=O)CSc2nc(=O)cc(N)[nH]2)c1
451548,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,307.08594,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451549,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,307.08594,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451550,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,307.08594,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451551,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,307.08594,[M+H]+,15.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451552,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1,307.08594,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)o1
451553,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1,307.08594,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1
451554,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1,307.08594,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1
451555,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1,307.08594,[M+H]+,60.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1
451556,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1,307.08594,[M+H]+,30.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1
451557,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1,307.08594,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(n2nccn2)C1
451558,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,307.08594,[M+H]+,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451559,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,307.08594,[M+H]+,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451560,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,307.08594,[M+H]+,60.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451561,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,307.08594,[M+H]+,30.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451562,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1,307.08594,[M+H]+,20.0,val,O=C(NCCNS(=O)(=O)c1ccccc1)c1cnccn1
451563,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451564,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451565,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451566,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,30.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451567,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451568,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451569,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,30.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451570,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,337.06122,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451571,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,339.07577,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451572,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,339.07577,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451573,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,339.07577,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451574,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,339.07577,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451575,Cc1c(C(=O)O)ccc(S(=O)(=O)Nc2cn(CC(N)=O)nc2)c1,339.07577,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)ccc1C(=O)O
451576,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,325.00157,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451577,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,325.00157,[M-H]-,60.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451578,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,325.00157,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451579,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,325.00157,[M-H]-,45.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451580,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451581,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451582,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,327.01612,[M+H]+,60.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451583,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,327.01612,[M+H]+,30.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451584,Cc1c(Br)cc(C(=O)NC(=S)N2CCCC2)cc1,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451585,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451586,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451587,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br,327.01612,[M+H]+,60.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451588,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br,327.01612,[M+H]+,30.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451589,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br,327.01612,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)N2CCCC2)cc1Br
451590,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,20.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451591,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,20.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451592,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,60.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451593,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,30.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451594,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,20.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451595,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,45.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451596,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,60.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451597,C#CCN(C)CCCOc1c(Cl)cc(Cl)cc1,272.06034,[M+H]+,20.0,val,C#CCN(C)CCCOc1ccc(Cl)cc1Cl
451598,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451599,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451600,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,30.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451601,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,60.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451602,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,15.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451603,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451604,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,60.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451605,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,309.07599,[M-H]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451606,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,345.05267,[M+Cl]-,15.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451607,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,345.05267,[M+Cl]-,15.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451608,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,345.05267,[M+Cl]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451609,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,345.05267,[M+Cl]-,60.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451610,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,345.05267,[M+Cl]-,15.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451611,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,355.08147,[M+FA]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451612,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,355.08147,[M+FA]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451613,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,355.08147,[M+FA]-,60.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451614,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,355.08147,[M+FA]-,15.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451615,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,355.08147,[M+FA]-,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451616,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,311.09054,[M+H]+,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451617,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,311.09054,[M+H]+,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451618,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,311.09054,[M+H]+,60.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451619,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,311.09054,[M+H]+,30.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451620,CC(C)N1C(=O)CC(NC(=O)Nc2cc(Cl)cnc2)C1=O,311.09054,[M+H]+,20.0,val,CC(C)N1C(=O)CC(NC(=O)Nc2cncc(Cl)c2)C1=O
451621,COCCc1nc(CNc2c(C(N)=O)cc(Cl)cc2)no1,311.09054,[M+H]+,20.0,val,COCCc1nc(CNc2ccc(Cl)cc2C(N)=O)no1
451622,COCCc1nc(CNc2c(C(N)=O)cc(Cl)cc2)no1,311.09054,[M+H]+,20.0,val,COCCc1nc(CNc2ccc(Cl)cc2C(N)=O)no1
451623,COCCc1nc(CNc2c(C(N)=O)cc(Cl)cc2)no1,311.09054,[M+H]+,60.0,val,COCCc1nc(CNc2ccc(Cl)cc2C(N)=O)no1
451624,COCCc1nc(CNc2c(C(N)=O)cc(Cl)cc2)no1,311.09054,[M+H]+,15.0,val,COCCc1nc(CNc2ccc(Cl)cc2C(N)=O)no1
451625,COCCc1nc(CNc2c(C(N)=O)cc(Cl)cc2)no1,311.09054,[M+H]+,20.0,val,COCCc1nc(CNc2ccc(Cl)cc2C(N)=O)no1
451626,COCCOc1ncc(CNc2c(Cl)c(=O)[nH]nc2)cc1,311.09054,[M+H]+,20.0,val,COCCOc1ccc(CNc2cn[nH]c(=O)c2Cl)cn1
451627,COCCOc1ncc(CNc2c(Cl)c(=O)[nH]nc2)cc1,311.09054,[M+H]+,20.0,val,COCCOc1ccc(CNc2cn[nH]c(=O)c2Cl)cn1
451628,COCCOc1ncc(CNc2c(Cl)c(=O)[nH]nc2)cc1,311.09054,[M+H]+,60.0,val,COCCOc1ccc(CNc2cn[nH]c(=O)c2Cl)cn1
451629,COCCOc1ncc(CNc2c(Cl)c(=O)[nH]nc2)cc1,311.09054,[M+H]+,30.0,val,COCCOc1ccc(CNc2cn[nH]c(=O)c2Cl)cn1
451630,COCCOc1ncc(CNc2c(Cl)c(=O)[nH]nc2)cc1,311.09054,[M+H]+,20.0,val,COCCOc1ccc(CNc2cn[nH]c(=O)c2Cl)cn1
451631,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1,307.10686,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1
451632,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1,307.10686,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1
451633,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1,307.10686,[M+H]+,45.0,val,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1
451634,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1,307.10686,[M+H]+,60.0,val,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1
451635,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1,307.10686,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1
451636,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451637,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451638,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,60.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451639,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451640,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,60.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451641,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,303.0962,[M-H]-,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451642,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1,305.11075,[M+H]+,20.0,val,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1
451643,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1,305.11075,[M+H]+,20.0,val,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1
451644,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1,305.11075,[M+H]+,60.0,val,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1
451645,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1,305.11075,[M+H]+,15.0,val,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1
451646,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1,305.11075,[M+H]+,20.0,val,O=C(Cn1cccc(C(F)(F)F)c1=O)NCC1CCCO1
451647,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451648,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451649,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,60.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451650,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,30.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451651,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451652,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,60.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451653,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,30.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451654,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1,305.11075,[M+H]+,20.0,val,COC1CCN(C(=O)c2cc(C(F)(F)F)c[nH]c2=O)CC1
451655,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,20.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451656,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,20.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451657,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,45.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451658,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,60.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451659,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,20.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451660,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,45.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451661,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,60.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451662,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1,307.11357,[M+H]+,20.0,val,CSc1nccc(N2CCN(c3ncncc3F)CC2)n1
451663,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451664,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451665,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,60.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451666,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,30.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451667,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451668,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,60.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451669,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,30.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451670,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,308.05329,[M-H]-,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451671,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,310.06784,[M+H]+,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451672,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,310.06784,[M+H]+,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451673,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,310.06784,[M+H]+,60.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451674,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,310.06784,[M+H]+,15.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451675,CNC(=O)CSc1nc2c(c3c(CCCC3)s2)c(=O)[nH]1,310.06784,[M+H]+,20.0,val,CNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
451676,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1,310.06784,[M+H]+,20.0,val,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1
451677,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1,310.06784,[M+H]+,20.0,val,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1
451678,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1,310.06784,[M+H]+,60.0,val,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1
451679,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1,310.06784,[M+H]+,30.0,val,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1
451680,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1,310.06784,[M+H]+,20.0,val,CCOC(=O)C(Cc1ccccc1)Sc1nnc(N)s1
451681,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451682,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451683,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,30.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451684,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,60.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451685,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451686,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,45.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451687,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451688,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,308.05329,[M-H]-,60.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451689,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451690,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451691,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,60.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451692,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,30.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451693,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451694,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,30.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451695,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451696,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,308.05329,[M-H]-,60.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451697,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451698,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451699,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,45.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451700,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,60.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451701,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451702,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,45.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451703,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,60.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451704,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,308.05329,[M-H]-,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451705,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,344.02997,[M+Cl]-,15.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451706,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,344.02997,[M+Cl]-,15.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451707,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,344.02997,[M+Cl]-,60.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451708,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451709,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451710,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,45.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451711,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,60.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451712,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451713,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,45.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451714,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,60.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451715,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,308.05329,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451716,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,344.02997,[M+Cl]-,15.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451717,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,344.02997,[M+Cl]-,15.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451718,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,344.02997,[M+Cl]-,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451719,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,344.02997,[M+Cl]-,60.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451720,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,344.02997,[M+Cl]-,15.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451721,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451722,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451723,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,60.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451724,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451725,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,60.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451726,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1,310.06784,[M+H]+,20.0,val,CSc1ncc(C)c(Nc2ccc(S(C)(=O)=O)cc2)n1
451727,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451728,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451729,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,60.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451730,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,15.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451731,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451732,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,45.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451733,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,60.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451734,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1,310.06784,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2nccs2)C1)c1ccccc1
451735,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,310.06784,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451736,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,310.06784,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451737,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,310.06784,[M+H]+,60.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451738,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,310.06784,[M+H]+,30.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451739,CCOCc1nnc(NC(=O)CSc2ccccc2)s1,310.06784,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)CSc2ccccc2)s1
451740,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451741,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451742,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,60.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451743,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,30.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451744,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451745,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,30.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451746,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,20.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451747,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1,310.06784,[M+H]+,60.0,val,COCc1nnc(NC(=O)CSc2ccc(C)cc2)s1
451748,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,368.0702,[M+Cl]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451749,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,368.0702,[M+Cl]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451750,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,368.0702,[M+Cl]-,60.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451751,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,368.0702,[M+Cl]-,15.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451752,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,368.0702,[M+Cl]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451753,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,378.099,[M+FA]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451754,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,378.099,[M+FA]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451755,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,378.099,[M+FA]-,60.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451756,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,378.099,[M+FA]-,15.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451757,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,378.099,[M+FA]-,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451758,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,334.10807,[M+H]+,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451759,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,334.10807,[M+H]+,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451760,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,334.10807,[M+H]+,60.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451761,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,334.10807,[M+H]+,15.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451762,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1,334.10807,[M+H]+,20.0,val,Cc1noc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1
451763,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12,312.03697,[M-H]-,20.0,val,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12
451764,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12,312.03697,[M-H]-,20.0,val,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12
451765,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12,312.03697,[M-H]-,60.0,val,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12
451766,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12,312.03697,[M-H]-,30.0,val,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12
451767,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12,312.03697,[M-H]-,20.0,val,CCCN(CC(=O)O)S(=O)(=O)c1csc2ccccc12
451768,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC,312.03697,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC
451769,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC,312.03697,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC
451770,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC,312.03697,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC
451771,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC,312.03697,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC
451772,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC,312.03697,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCc2cccs2)cc1OC
451773,Cc1c(C(=O)NC2(CO)CCOC2)cccc1Br,312.02408,[M-H]-,20.0,val,Cc1c(Br)cccc1C(=O)NC1(CO)CCOC1
451774,Cc1c(C(=O)NC2(CO)CCOC2)cccc1Br,312.02408,[M-H]-,20.0,val,Cc1c(Br)cccc1C(=O)NC1(CO)CCOC1
451775,Cc1c(C(=O)NC2(CO)CCOC2)cccc1Br,312.02408,[M-H]-,60.0,val,Cc1c(Br)cccc1C(=O)NC1(CO)CCOC1
451776,Cc1c(C(=O)NC2(CO)CCOC2)cccc1Br,312.02408,[M-H]-,20.0,val,Cc1c(Br)cccc1C(=O)NC1(CO)CCOC1
451777,Cc1c(C(=O)NC2(CO)CCOC2)cccc1Br,312.02408,[M-H]-,45.0,val,Cc1c(Br)cccc1C(=O)NC1(CO)CCOC1
451778,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451779,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451780,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,45.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451781,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,60.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451782,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451783,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,45.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451784,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,60.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451785,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,312.02408,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451786,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,348.00076,[M+Cl]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451787,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,348.00076,[M+Cl]-,15.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451788,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,348.00076,[M+Cl]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451789,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,348.00076,[M+Cl]-,15.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451790,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,348.00076,[M+Cl]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451791,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,358.02956,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451792,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,358.02956,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451793,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,358.02956,[M+FA]-,60.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451794,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,358.02956,[M+FA]-,15.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451795,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,358.02956,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451796,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,296.02807,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451797,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,296.02807,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451798,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,296.02807,[M+H-H2O]+,60.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451799,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,296.02807,[M+H-H2O]+,30.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451800,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,296.02807,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451801,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,314.03863,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451802,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,314.03863,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451803,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,314.03863,[M+H]+,60.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451804,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,314.03863,[M+H]+,15.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451805,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1,314.03863,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)c1cccc(Br)c1
451806,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1,314.03863,[M+H]+,20.0,val,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1
451807,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1,314.03863,[M+H]+,20.0,val,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1
451808,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1,314.03863,[M+H]+,60.0,val,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1
451809,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1,314.03863,[M+H]+,30.0,val,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1
451810,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1,314.03863,[M+H]+,20.0,val,Cc1ccc(OCC(=O)N2CCOCC2)c(Br)c1
451811,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,20.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451812,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,20.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451813,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,60.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451814,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,30.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451815,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,20.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451816,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,30.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451817,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,60.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451818,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1,310.08877,[M+H]+,20.0,val,Cc1nsc(N2C3CCC2CC(n2cc(Cl)cn2)C3)n1
451819,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451820,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451821,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451822,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,30.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451823,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451824,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,30.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451825,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451826,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,316.02382,[M-H]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451827,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451828,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451829,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451830,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,15.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451831,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451832,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,15.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451833,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451834,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,352.0005,[M+Cl]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451835,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,362.0293,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451836,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,362.0293,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451837,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,362.0293,[M+FA]-,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451838,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,362.0293,[M+FA]-,15.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451839,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,362.0293,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451840,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,300.02781,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451841,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,300.02781,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451842,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,300.02781,[M+H-H2O]+,60.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451843,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,300.02781,[M+H-H2O]+,30.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451844,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1,300.02781,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)c1cccc(Cl)c1
451845,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,20.0,val,O=C1Nc2ccccc2CC12CCNCC2
451846,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,20.0,val,O=C1Nc2ccccc2CC12CCNCC2
451847,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,60.0,val,O=C1Nc2ccccc2CC12CCNCC2
451848,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,20.0,val,O=C1Nc2ccccc2CC12CCNCC2
451849,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,45.0,val,O=C1Nc2ccccc2CC12CCNCC2
451850,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,60.0,val,O=C1Nc2ccccc2CC12CCNCC2
451851,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,20.0,val,O=C1Nc2ccccc2CC12CCNCC2
451852,O=C1Nc2ccccc2CC12CCNCC2,217.13354,[M+H]+,45.0,val,O=C1Nc2ccccc2CC12CCNCC2
451853,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,20.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451854,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,20.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451855,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,60.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451856,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,30.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451857,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,20.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451858,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,60.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451859,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,30.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451860,c1ccc(C2CC2)c(OCC2=NCCN2)c1,217.13354,[M+H]+,20.0,val,c1ccc(C2CC2)c(OCC2=NCCN2)c1
451861,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451862,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451863,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,45.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451864,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,60.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451865,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451866,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451867,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,45.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451868,Cc1ccc2c(c1)NC(=O)C21CCNCC1,217.13354,[M+H]+,60.0,val,Cc1ccc2c(c1)NC(=O)C21CCNCC1
451869,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451870,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451871,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,45.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451872,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,60.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451873,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451874,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,20.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451875,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2,217.13354,[M+H]+,60.0,val,Cc1ccc2c(c1)C1(CCNCC1)C(=O)N2
451876,COc1ccc2c3c([nH]c2c1)C(C)NCC3,217.13354,[M+H]+,20.0,val,COc1ccc2c3c([nH]c2c1)C(C)NCC3
451877,COc1ccc2c3c([nH]c2c1)C(C)NCC3,217.13354,[M+H]+,20.0,val,COc1ccc2c3c([nH]c2c1)C(C)NCC3
451878,COc1ccc2c3c([nH]c2c1)C(C)NCC3,217.13354,[M+H]+,15.0,val,COc1ccc2c3c([nH]c2c1)C(C)NCC3
451879,COc1ccc2c3c([nH]c2c1)C(C)NCC3,217.13354,[M+H]+,20.0,val,COc1ccc2c3c([nH]c2c1)C(C)NCC3
451880,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,20.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451881,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,20.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451882,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,60.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451883,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,20.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451884,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,45.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451885,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,60.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451886,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,20.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451887,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1,279.08089,[M-H]-,45.0,val,CC(C)CCC(=O)NS(=O)(=O)c1cccc(C#N)c1
451888,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451889,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451890,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,60.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451891,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,15.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451892,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451893,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,60.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451894,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,15.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451895,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,279.08089,[M-H]-,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451896,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,281.09544,[M+H]+,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451897,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,281.09544,[M+H]+,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451898,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,281.09544,[M+H]+,60.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451899,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,281.09544,[M+H]+,15.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451900,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1,281.09544,[M+H]+,20.0,val,O=C(O)c1csc(CCNC(=O)C2CC=CCC2)n1
451901,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451902,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451903,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,60.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451904,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,30.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451905,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451906,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,60.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451907,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,30.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451908,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,279.08089,[M-H]-,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451909,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451910,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451911,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,60.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451912,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,30.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451913,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451914,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,60.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451915,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,30.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451916,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,281.09544,[M+H]+,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451917,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,303.07738,[M+Na]+,45.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451918,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,303.07738,[M+Na]+,45.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451919,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,303.07738,[M+Na]+,20.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451920,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,303.07738,[M+Na]+,60.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451921,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1,303.07738,[M+Na]+,45.0,val,O=C(O)C1CC2CCCCC2N1C(=O)c1cscn1
451922,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451923,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451924,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,60.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451925,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451926,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,45.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451927,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,60.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451928,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451929,CSc1nc2c(c(SC)n1)c1c(COC(C)(C)C1)s2,313.04975,[M+H]+,45.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451930,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451931,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451932,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3,313.04975,[M+H]+,45.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451933,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3,313.04975,[M+H]+,60.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451934,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3,313.04975,[M+H]+,20.0,val,CSc1nc(SC)c2c3c(sc2n1)COC(C)(C)C3
451935,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,271.13128,[M-H]-,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451936,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,271.13128,[M-H]-,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451937,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,271.13128,[M-H]-,60.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451938,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,271.13128,[M-H]-,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451939,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,271.13128,[M-H]-,45.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451940,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451941,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451942,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,60.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451943,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,30.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451944,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451945,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,60.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451946,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,30.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451947,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,271.13128,[M-H]-,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451948,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451949,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451950,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,60.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451951,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451952,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,45.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451953,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,60.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451954,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451955,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,271.13128,[M-H]-,45.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451956,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,307.10796,[M+Cl]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451957,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,307.10796,[M+Cl]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451958,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,307.10796,[M+Cl]-,60.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451959,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,307.10796,[M+Cl]-,15.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451960,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,307.10796,[M+Cl]-,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451961,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451962,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451963,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,30.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451964,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,60.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451965,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451966,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,45.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451967,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,60.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451968,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,273.14583,[M+H]+,20.0,val,O=c1[nH]nc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1
451969,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,20.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451970,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,20.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451971,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,60.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451972,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,20.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451973,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,45.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451974,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,60.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451975,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,20.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451976,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1,273.14583,[M+H]+,45.0,val,Cc1cc(CN(C)c2c(C)c(C)nc3ncnn23)no1
451977,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451978,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451979,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,15.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451980,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,60.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451981,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,30.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451982,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451983,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,60.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451984,C[C@H]1C[C@]2(C(=O)Nc3c(-c4ccnn4C)[nH]nn3)C[C@H]12,273.14583,[M+H]+,20.0,val,C[C@H]1C[C@]2(C(=O)Nc3nn[nH]c3-c3ccnn3C)C[C@H]12
451985,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451986,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451987,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,30.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451988,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,60.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451989,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451990,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,45.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451991,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,60.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451992,O=C1CCCN1C1CCN(c2c3[nH]cnc3ncn2)C1,273.14583,[M+H]+,20.0,val,O=C1CCCN1C1CCN(c2ncnc3nc[nH]c23)C1
451993,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451994,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451995,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,60.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451996,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,30.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451997,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451998,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,60.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
451999,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,30.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452000,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,289.14075,[M+H]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452001,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,311.12269,[M+Na]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452002,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,311.12269,[M+Na]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452003,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,311.12269,[M+Na]+,60.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452004,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,311.12269,[M+Na]+,30.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452005,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1,311.12269,[M+Na]+,20.0,val,CC(OCC1CC1)C(=O)Nc1ncnn1-c1ncccn1
452006,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452007,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452008,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,319.09827,[M-H]-,60.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452009,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,319.09827,[M-H]-,15.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452010,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452011,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452012,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452013,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,321.11282,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452014,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,321.11282,[M+H]+,30.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452015,CNC(=O)NC(=O)CSc1c2CCCCc2nc2ncnn12,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452016,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452017,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452018,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,319.09827,[M-H]-,60.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452019,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,319.09827,[M-H]-,30.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452020,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452021,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452022,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452023,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,319.09827,[M-H]-,60.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452024,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,319.09827,[M-H]-,15.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452025,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,319.09827,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452026,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452027,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452028,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,321.11282,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452029,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,321.11282,[M+H]+,15.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452030,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N
452031,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452032,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452033,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,321.11282,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452034,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,321.11282,[M+H]+,30.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452035,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2,321.11282,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1c2c(nc3ncnn13)CCCC2
452036,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1,329.04953,[M+H]+,20.0,val,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1
452037,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1,329.04953,[M+H]+,20.0,val,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1
452038,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1,329.04953,[M+H]+,60.0,val,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1
452039,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1,329.04953,[M+H]+,30.0,val,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1
452040,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1,329.04953,[M+H]+,20.0,val,CCOCC(=O)N1CCC(Oc2ncccc2Br)C1
452041,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O,329.04953,[M+H]+,20.0,val,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O
452042,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O,329.04953,[M+H]+,20.0,val,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O
452043,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O,329.04953,[M+H]+,60.0,val,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O
452044,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O,329.04953,[M+H]+,15.0,val,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O
452045,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O,329.04953,[M+H]+,20.0,val,COc1cc(CNC2CC2)cc(Br)c1OCC(N)=O
452046,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452047,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452048,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,45.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452049,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,60.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452050,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452051,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452052,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,45.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452053,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,331.05248,[M-H]-,60.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452054,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,367.02916,[M+Cl]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452055,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,367.02916,[M+Cl]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452056,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,367.02916,[M+Cl]-,60.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452057,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,367.02916,[M+Cl]-,15.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452058,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1,367.02916,[M+Cl]-,20.0,val,CC1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1
452059,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,349.09516,[M-H]-,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452060,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,349.09516,[M-H]-,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452061,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,349.09516,[M-H]-,60.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452062,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,349.09516,[M-H]-,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452063,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,349.09516,[M-H]-,45.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452064,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452065,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452066,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,60.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452067,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,30.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452068,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452069,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,60.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452070,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,30.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452071,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1,351.10971,[M+H]+,20.0,val,O=C(Nc1nnc(CC(F)(F)F)s1)N1CCCC1C1CCCO1
452072,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,20.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452073,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,60.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452074,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,30.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452075,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,20.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452076,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,60.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452077,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,30.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452078,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1,351.10971,[M+H]+,20.0,val,CN(C)CC(=O)N1CCN(C(=O)c2csc(C(F)(F)F)n2)CC1
452079,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452080,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452081,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452082,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,30.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452083,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452084,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452085,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,30.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452086,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,329.13432,[M-H]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452087,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,365.111,[M+Cl]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452088,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,365.111,[M+Cl]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452089,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,365.111,[M+Cl]-,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452090,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,365.111,[M+Cl]-,15.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452091,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,365.111,[M+Cl]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452092,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452093,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452094,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452095,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,15.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452096,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452097,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452098,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,15.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452099,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,375.1398,[M+FA]-,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452100,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452101,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452102,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452103,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,30.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452104,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452105,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,60.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452106,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,30.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452107,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C,331.14887,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)NCc1cc(C(F)(F)F)nn1C
452108,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,278.11463,[M-H]-,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452109,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,278.11463,[M-H]-,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452110,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,278.11463,[M-H]-,60.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452111,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,278.11463,[M-H]-,30.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452112,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,278.11463,[M-H]-,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452113,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,278.11463,[M-H]-,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452114,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,278.11463,[M-H]-,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452115,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,278.11463,[M-H]-,60.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452116,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,278.11463,[M-H]-,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452117,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,278.11463,[M-H]-,45.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452118,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,280.12918,[M+H]+,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452119,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,280.12918,[M+H]+,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452120,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,280.12918,[M+H]+,60.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452121,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,280.12918,[M+H]+,30.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452122,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1,280.12918,[M+H]+,20.0,val,O=C(NCC1COCCO1)c1cc(=O)[nH]c(C2CC2)n1
452123,O=C(NCCC(=O)N1CCOCC1)c1c(O)cccn1,280.12918,[M+H]+,20.0,val,O=C(NCCC(=O)N1CCOCC1)c1ncccc1O
452124,O=C(NCCC(=O)N1CCOCC1)c1c(O)cccn1,280.12918,[M+H]+,20.0,val,O=C(NCCC(=O)N1CCOCC1)c1ncccc1O
452125,O=C(NCCC(=O)N1CCOCC1)c1c(O)cccn1,280.12918,[M+H]+,60.0,val,O=C(NCCC(=O)N1CCOCC1)c1ncccc1O
452126,O=C(NCCC(=O)N1CCOCC1)c1c(O)cccn1,280.12918,[M+H]+,15.0,val,O=C(NCCC(=O)N1CCOCC1)c1ncccc1O
452127,O=C(NCCC(=O)N1CCOCC1)c1c(O)cccn1,280.12918,[M+H]+,20.0,val,O=C(NCCC(=O)N1CCOCC1)c1ncccc1O
452128,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,280.12918,[M+H]+,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452129,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,280.12918,[M+H]+,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452130,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,280.12918,[M+H]+,60.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452131,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,280.12918,[M+H]+,30.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452132,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1,280.12918,[M+H]+,20.0,val,O=C(CCn1[nH]c(=O)ccc1=O)N1CC[C@H]2C[C@@]2(O)C1
452133,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452134,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452135,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,60.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452136,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452137,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,45.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452138,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,60.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452139,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452140,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,338.09285,[M-H]-,45.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452141,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,384.09833,[M+FA]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452142,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,384.09833,[M+FA]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452143,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,384.09833,[M+FA]-,60.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452144,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,384.09833,[M+FA]-,15.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452145,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,384.09833,[M+FA]-,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452146,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,340.1074,[M+H]+,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452147,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,340.1074,[M+H]+,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452148,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,340.1074,[M+H]+,60.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452149,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,340.1074,[M+H]+,30.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452150,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O,340.1074,[M+H]+,20.0,val,C[C@H]1CN(C(=O)c2cnc3[nH]c(=O)[nH]c3c2)CCN1S(C)(=O)=O
452151,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452152,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452153,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452154,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452155,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,45.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452156,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452157,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452158,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452159,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,30.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452160,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452161,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452162,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452163,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,45.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452164,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452165,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452166,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,45.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452167,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452168,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,338.09285,[M-H]-,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452169,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452170,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452171,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452172,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,30.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452173,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452174,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,20.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452175,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,30.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452176,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1,340.1074,[M+H]+,60.0,val,CCCCOC(=O)Nc1ccc(S(=O)(=O)Nn2cnnc2)cc1
452177,O=C(O)C(c1ccccc1)C1CCNCC1,220.13321,[M+H]+,20.0,val,O=C(O)C(c1ccccc1)C1CCNCC1
452178,O=C(O)C(c1ccccc1)C1CCNCC1,220.13321,[M+H]+,20.0,val,O=C(O)C(c1ccccc1)C1CCNCC1
452179,O=C(O)C(c1ccccc1)C1CCNCC1,220.13321,[M+H]+,60.0,val,O=C(O)C(c1ccccc1)C1CCNCC1
452180,O=C(O)C(c1ccccc1)C1CCNCC1,220.13321,[M+H]+,30.0,val,O=C(O)C(c1ccccc1)C1CCNCC1
452181,O=C(O)C(c1ccccc1)C1CCNCC1,220.13321,[M+H]+,20.0,val,O=C(O)C(c1ccccc1)C1CCNCC1
452182,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,20.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452183,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,20.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452184,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,60.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452185,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,20.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452186,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,45.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452187,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,60.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452188,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,20.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452189,O=C(O)c1cccc(CN2CCCCC2)c1,220.13321,[M+H]+,45.0,val,O=C(O)c1cccc(CN2CCCCC2)c1
452190,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,20.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452191,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,20.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452192,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,60.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452193,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,30.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452194,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,20.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452195,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,60.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452196,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,30.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452197,Cc1ccc(C2(C(=O)O)CCNCC2)cc1,220.13321,[M+H]+,20.0,val,Cc1ccc(C2(C(=O)O)CCNCC2)cc1
452198,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452199,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452200,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,60.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452201,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,30.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452202,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452203,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,60.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452204,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,30.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452205,Cc1cc(C2(C(=O)O)CCNCC2)ccc1,220.13321,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)O)CCNCC2)c1
452206,CC(CC(=O)O)N1CCCc2ccccc21,219.12538,[M]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452207,CC(CC(=O)O)N1CCCc2ccccc21,219.12538,[M]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452208,CC(CC(=O)O)N1CCCc2ccccc21,219.12538,[M]+,60.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452209,CC(CC(=O)O)N1CCCc2ccccc21,219.12538,[M]+,30.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452210,CC(CC(=O)O)N1CCCc2ccccc21,219.12538,[M]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452211,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452212,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452213,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,60.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452214,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,30.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452215,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452216,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,60.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452217,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,30.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452218,CC(CC(=O)O)N1CCCc2ccccc21,220.13321,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCc2ccccc21
452219,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,20.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452220,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,20.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452221,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,60.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452222,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,20.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452223,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,45.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452224,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,60.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452225,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,20.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452226,O=C(O)c1ccc(CN2CCCCC2)cc1,220.13321,[M+H]+,45.0,val,O=C(O)c1ccc(CN2CCCCC2)cc1
452227,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,20.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452228,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,20.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452229,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,60.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452230,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,30.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452231,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,20.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452232,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,60.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452233,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,30.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452234,CN1CCC(c2ccccc2)CC1C(=O)O,220.13321,[M+H]+,20.0,val,CN1CCC(c2ccccc2)CC1C(=O)O
452235,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452236,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452237,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,15.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452238,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,60.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452239,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,30.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452240,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452241,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,60.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452242,CC1(C)CCC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC1(C)CCC(N)(C(=O)O)c2ccccc21
452243,CC(C)C1CC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC(C)C1CC(N)(C(=O)O)c2ccccc21
452244,CC(C)C1CC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC(C)C1CC(N)(C(=O)O)c2ccccc21
452245,CC(C)C1CC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,60.0,val,CC(C)C1CC(N)(C(=O)O)c2ccccc21
452246,CC(C)C1CC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,15.0,val,CC(C)C1CC(N)(C(=O)O)c2ccccc21
452247,CC(C)C1CC(N)(C(=O)O)c2ccccc21,220.13321,[M+H]+,20.0,val,CC(C)C1CC(N)(C(=O)O)c2ccccc21
452248,CN1CCC[C@H]1COC(=O)c1ccccc1,220.13321,[M+H]+,20.0,val,CN1CCC[C@H]1COC(=O)c1ccccc1
452249,CN1CCC[C@H]1COC(=O)c1ccccc1,220.13321,[M+H]+,20.0,val,CN1CCC[C@H]1COC(=O)c1ccccc1
452250,CN1CCC[C@H]1COC(=O)c1ccccc1,220.13321,[M+H]+,60.0,val,CN1CCC[C@H]1COC(=O)c1ccccc1
452251,CN1CCC[C@H]1COC(=O)c1ccccc1,220.13321,[M+H]+,30.0,val,CN1CCC[C@H]1COC(=O)c1ccccc1
452252,CN1CCC[C@H]1COC(=O)c1ccccc1,220.13321,[M+H]+,20.0,val,CN1CCC[C@H]1COC(=O)c1ccccc1
452253,C=C(C)CNc1ccc(C(C)C(=O)O)cc1,220.13321,[M+H]+,20.0,val,C=C(C)CNc1ccc(C(C)C(=O)O)cc1
452254,C=C(C)CNc1ccc(C(C)C(=O)O)cc1,220.13321,[M+H]+,20.0,val,C=C(C)CNc1ccc(C(C)C(=O)O)cc1
452255,C=C(C)CNc1ccc(C(C)C(=O)O)cc1,220.13321,[M+H]+,60.0,val,C=C(C)CNc1ccc(C(C)C(=O)O)cc1
452256,C=C(C)CNc1ccc(C(C)C(=O)O)cc1,220.13321,[M+H]+,30.0,val,C=C(C)CNc1ccc(C(C)C(=O)O)cc1
452257,C=C(C)CNc1ccc(C(C)C(=O)O)cc1,220.13321,[M+H]+,20.0,val,C=C(C)CNc1ccc(C(C)C(=O)O)cc1
452258,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,20.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452259,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,20.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452260,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,45.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452261,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,60.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452262,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,20.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452263,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,20.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452264,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,45.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452265,COC(=O)c1cccc(C2CCNCC2)c1,220.13321,[M+H]+,60.0,val,COC(=O)c1cccc(C2CCNCC2)c1
452266,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452267,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452268,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,45.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452269,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,60.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452270,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452271,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452272,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,45.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452273,COC(=O)c1ccc(C2CCNCC2)cc1,220.13321,[M+H]+,60.0,val,COC(=O)c1ccc(C2CCNCC2)cc1
452274,COc1ccc(C(=O)C2CCNCC2)cc1,202.12265,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452275,COc1ccc(C(=O)C2CCNCC2)cc1,202.12265,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452276,COc1ccc(C(=O)C2CCNCC2)cc1,202.12265,[M+H-H2O]+,60.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452277,COc1ccc(C(=O)C2CCNCC2)cc1,202.12265,[M+H-H2O]+,30.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452278,COc1ccc(C(=O)C2CCNCC2)cc1,202.12265,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452279,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452280,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452281,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,45.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452282,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,60.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452283,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452284,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,45.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452285,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,20.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452286,COc1ccc(C(=O)C2CCNCC2)cc1,220.13321,[M+H]+,60.0,val,COc1ccc(C(=O)C2CCNCC2)cc1
452287,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,20.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452288,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,20.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452289,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,60.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452290,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,30.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452291,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,20.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452292,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,60.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452293,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,30.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452294,CCOCC1CCN(C(=O)Nc2c(Br)cncc2)C1,328.06552,[M+H]+,20.0,val,CCOCC1CCN(C(=O)Nc2ccncc2Br)C1
452295,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,297.0726,[M+H-H2O]+,30.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452296,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,297.0726,[M+H-H2O]+,30.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452297,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,297.0726,[M+H-H2O]+,20.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452298,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,297.0726,[M+H-H2O]+,60.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452299,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,297.0726,[M+H-H2O]+,30.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452300,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,315.08316,[M+H]+,20.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452301,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,315.08316,[M+H]+,20.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452302,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,315.08316,[M+H]+,60.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452303,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,315.08316,[M+H]+,15.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452304,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O,315.08316,[M+H]+,20.0,val,Cn1cccc(C(=O)NCC2(O)CSCCSC2)c1=O
452305,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452306,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452307,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,60.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452308,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,30.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452309,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452310,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,60.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452311,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,30.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452312,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,281.1143,[M-H]-,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452313,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,317.09097,[M+Cl]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452314,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,317.09097,[M+Cl]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452315,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,317.09097,[M+Cl]-,60.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452316,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,317.09097,[M+Cl]-,15.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452317,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,317.09097,[M+Cl]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452318,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,327.11977,[M+FA]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452319,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,327.11977,[M+FA]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452320,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,327.11977,[M+FA]-,60.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452321,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,327.11977,[M+FA]-,15.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452322,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,327.11977,[M+FA]-,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452323,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,283.12885,[M+H]+,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452324,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,283.12885,[M+H]+,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452325,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,283.12885,[M+H]+,60.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452326,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,283.12885,[M+H]+,15.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452327,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,283.12885,[M+H]+,20.0,val,CC(C)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1
452328,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,283.12885,[M+H]+,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452329,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,283.12885,[M+H]+,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452330,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,283.12885,[M+H]+,60.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452331,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,283.12885,[M+H]+,15.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452332,COCC(C)(CC(=O)O)NC(=O)c1cn(C)c(=O)cc1,283.12885,[M+H]+,20.0,val,COCC(C)(CC(=O)O)NC(=O)c1ccc(=O)n(C)c1
452333,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,309.10269,[M-H]-,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452334,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,309.10269,[M-H]-,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452335,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,309.10269,[M-H]-,60.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452336,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,309.10269,[M-H]-,30.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452337,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,309.10269,[M-H]-,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452338,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,311.11724,[M+H]+,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452339,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,311.11724,[M+H]+,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452340,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,311.11724,[M+H]+,60.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452341,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,311.11724,[M+H]+,15.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452342,NC(=O)NC(=O)CCN1CCN(C(=O)c2cscc2)CC1,311.11724,[M+H]+,20.0,val,NC(=O)NC(=O)CCN1CCN(C(=O)c2ccsc2)CC1
452343,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,309.10269,[M-H]-,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452344,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,309.10269,[M-H]-,30.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452345,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452346,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452347,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452348,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,60.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452349,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452350,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452351,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452352,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,60.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452353,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452354,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452355,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,309.10269,[M-H]-,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452356,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,309.10269,[M-H]-,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452357,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,309.10269,[M-H]-,60.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452358,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,309.10269,[M-H]-,30.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452359,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,309.10269,[M-H]-,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452360,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452361,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452362,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,60.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452363,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452364,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,355.10816,[M+FA]-,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452365,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,309.10269,[M-H]-,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452366,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,309.10269,[M-H]-,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452367,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,309.10269,[M-H]-,60.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452368,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,309.10269,[M-H]-,30.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452369,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,309.10269,[M-H]-,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452370,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,311.11724,[M+H]+,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452371,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,311.11724,[M+H]+,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452372,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,311.11724,[M+H]+,60.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452373,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,311.11724,[M+H]+,30.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452374,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1,311.11724,[M+H]+,20.0,val,O=C(NC1CCOCC1)N1CCN(c2nccs2)C(=O)C1
452375,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452376,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452377,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,60.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452378,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,15.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452379,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2,311.11724,[M+H]+,20.0,val,CCC(C)NC(=O)Cn1ncc2c(c1=O)N(C)C(=O)CS2
452380,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452381,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452382,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,60.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452383,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,30.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452384,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452385,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,60.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452386,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1,311.11724,[M+H]+,20.0,val,O=S(=O)(NCCn1cc(-c2ccoc2)cn1)N1CCCC1
452387,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452388,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452389,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452390,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,30.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452391,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452392,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,30.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452393,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452394,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,321.11392,[M-H]-,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452395,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,367.1194,[M+FA]-,20.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452396,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,367.1194,[M+FA]-,60.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452397,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,367.1194,[M+FA]-,15.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452398,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,367.1194,[M+FA]-,20.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452399,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452400,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452401,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452402,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,15.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452403,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452404,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452405,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452406,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1,323.12847,[M+H]+,15.0,val,Cc1ccc(N2CC(N(C)S(=O)(=O)c3nccn3C)C2)nn1
452407,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452408,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452409,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452410,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,30.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452411,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452412,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,45.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452413,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452414,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1,323.12847,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)NC1CN(c2cnccn2)C1
452415,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,60.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452416,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,60.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452417,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,20.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452418,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,60.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452419,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,60.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452420,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1,323.12847,[M+H]+,20.0,val,Cc1nccn1-c1ccc(N2CCN(S(C)(=O)=O)CC2)nn1
452421,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,353.08599,[M-H]-,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452422,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,353.08599,[M-H]-,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452423,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,353.08599,[M-H]-,60.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452424,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,353.08599,[M-H]-,30.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452425,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,353.08599,[M-H]-,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452426,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,355.10054,[M+H]+,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452427,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,355.10054,[M+H]+,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452428,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,355.10054,[M+H]+,60.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452429,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,355.10054,[M+H]+,30.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452430,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1,355.10054,[M+H]+,20.0,val,CC(=O)Nc1nnc(CCCCCc2nnc(NC(C)=O)s2)s1
452431,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,20.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452432,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,20.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452433,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,60.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452434,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,20.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452435,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,45.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452436,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,60.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452437,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,20.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452438,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1,343.05866,[M+H]+,45.0,val,CSc1ncc(Br)c(N2CCN(C3CCC3)CC2)n1
452439,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1,331.099,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1
452440,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1,331.099,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1
452441,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1,331.099,[M+H]+,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1
452442,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1,331.099,[M+H]+,30.0,val,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1
452443,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1,331.099,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(S(=O)(=O)C2CC2)CC1
452444,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452445,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452446,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,365.14421,[M+FA]-,60.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452447,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,365.14421,[M+FA]-,15.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452448,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452449,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452450,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452451,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452452,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,30.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452453,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452454,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452455,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,30.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452456,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,319.13873,[M-H]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452457,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,355.11541,[M+Cl]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452458,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,355.11541,[M+Cl]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452459,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,355.11541,[M+Cl]-,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452460,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,355.11541,[M+Cl]-,15.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452461,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,355.11541,[M+Cl]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452462,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,365.14421,[M+FA]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452463,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,365.14421,[M+FA]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452464,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,365.14421,[M+FA]-,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452465,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,365.14421,[M+FA]-,15.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452466,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,365.14421,[M+FA]-,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452467,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452468,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452469,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,60.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452470,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,30.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452471,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452472,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,60.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452473,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,30.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452474,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,319.13873,[M-H]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452475,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,355.11541,[M+Cl]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452476,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,355.11541,[M+Cl]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452477,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,355.11541,[M+Cl]-,60.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452478,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,355.11541,[M+Cl]-,15.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452479,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,355.11541,[M+Cl]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452480,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452481,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452482,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,60.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452483,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,15.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452484,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452485,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,60.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452486,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,15.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452487,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,365.14421,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452488,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452489,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452490,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452491,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,30.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452492,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452493,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,60.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452494,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,30.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452495,Cc1nn(C)c(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)c1,321.15329,[M+H]+,20.0,val,Cc1cc(NC(=O)N2CCCC(O)(C(F)(F)F)CC2)n(C)n1
452496,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452497,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452498,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,30.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452499,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,60.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452500,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,15.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452501,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452502,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,60.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452503,CC1(C)CC(NC(=O)Nc2nn(CC(F)(F)F)cc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2ccn(CC(F)(F)F)n2)CCO1
452504,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452505,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452506,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,321.15329,[M+H]+,15.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452507,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452508,CC1(C)CC(NC(=O)Nc2cn(CC(F)(F)F)nc2)CCO1,321.15329,[M+H]+,20.0,val,CC1(C)CC(NC(=O)Nc2cnn(CC(F)(F)F)c2)CCO1
452509,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,365.14421,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452510,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,365.14421,[M+FA]-,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452511,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,365.14421,[M+FA]-,15.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452512,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,365.14421,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452513,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452514,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452515,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452516,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,30.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452517,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452518,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452519,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,30.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452520,CC(C)(C)OC(=O)NCc1nnc2CCC(C(F)(F)F)Cn21,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452521,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,365.14421,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452522,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,365.14421,[M+FA]-,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452523,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,365.14421,[M+FA]-,15.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452524,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,365.14421,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452525,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452526,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452527,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452528,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,30.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452529,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452530,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452531,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,30.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452532,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2,321.15329,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1nnc2n1CC(C(F)(F)F)CC2
452533,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452534,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452535,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,60.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452536,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,30.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452537,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452538,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,60.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452539,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,30.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452540,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,280.11252,[M-H]-,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452541,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,20.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452542,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,20.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452543,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,60.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452544,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,30.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452545,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,20.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452546,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,60.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452547,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,30.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452548,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1,282.12707,[M+H]+,20.0,val,CC(NC(=O)c1cnc(NC2CC2)s1)C1CCOC1
452549,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,282.12707,[M+H]+,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452550,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,282.12707,[M+H]+,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452551,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,282.12707,[M+H]+,60.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452552,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,282.12707,[M+H]+,15.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452553,CNC(=O)c1cc(NC(=O)[C@H](N)CCSC)ccc1,282.12707,[M+H]+,20.0,val,CNC(=O)c1cccc(NC(=O)[C@H](N)CCSC)c1
452554,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1,282.12707,[M+H]+,20.0,val,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1
452555,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1,282.12707,[M+H]+,20.0,val,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1
452556,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1,282.12707,[M+H]+,60.0,val,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1
452557,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1,282.12707,[M+H]+,15.0,val,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1
452558,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1,282.12707,[M+H]+,20.0,val,N[C@@H]1c2ccccc2C[C@H]1NS(=O)(=O)N1CCCC1
452559,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,296.1252,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452560,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,296.1252,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452561,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,296.1252,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452562,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,296.1252,[M-H]-,30.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452563,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,296.1252,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452564,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,332.10187,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452565,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,332.10187,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452566,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,332.10187,[M+Cl]-,30.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452567,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,332.10187,[M+Cl]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452568,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,342.13067,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452569,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,342.13067,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452570,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,342.13067,[M+FA]-,60.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452571,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,342.13067,[M+FA]-,15.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452572,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,342.13067,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452573,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,298.13975,[M+H]+,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452574,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,298.13975,[M+H]+,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452575,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,298.13975,[M+H]+,60.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452576,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,298.13975,[M+H]+,15.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452577,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1,298.13975,[M+H]+,20.0,val,CC(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
452578,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452579,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452580,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452581,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,30.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452582,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452583,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452584,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,30.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452585,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452586,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,364.0917,[M+Cl]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452587,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,364.0917,[M+Cl]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452588,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,364.0917,[M+Cl]-,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452589,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,364.0917,[M+Cl]-,15.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452590,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,364.0917,[M+Cl]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452591,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452592,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452593,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452594,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,15.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452595,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452596,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452597,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452598,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452599,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,30.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452600,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452601,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452602,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,30.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452603,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,328.11502,[M-H]-,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452604,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452605,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452606,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452607,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,15.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452608,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452609,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,60.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452610,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,15.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452611,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O,330.12958,[M+H]+,20.0,val,CC(C)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O
452612,CN(C)c1c2ncn(CC3CCCOC3)c2ncn1,262.16624,[M+H]+,20.0,val,CN(C)c1ncnc2c1ncn2CC1CCCOC1
452613,CN(C)c1c2ncn(CC3CCCOC3)c2ncn1,262.16624,[M+H]+,20.0,val,CN(C)c1ncnc2c1ncn2CC1CCCOC1
452614,CN(C)c1c2ncn(CC3CCCOC3)c2ncn1,262.16624,[M+H]+,60.0,val,CN(C)c1ncnc2c1ncn2CC1CCCOC1
452615,CN(C)c1c2ncn(CC3CCCOC3)c2ncn1,262.16624,[M+H]+,20.0,val,CN(C)c1ncnc2c1ncn2CC1CCCOC1
452616,CN(C)c1c2ncn(CC3CCCOC3)c2ncn1,262.16624,[M+H]+,45.0,val,CN(C)c1ncnc2c1ncn2CC1CCCOC1
452617,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452618,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452619,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,30.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452620,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,60.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452621,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452622,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,45.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452623,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,60.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452624,CCc1nn(C)cc1NC(=O)c1nn(C(C)C)cc1,262.16624,[M+H]+,20.0,val,CCc1nn(C)cc1NC(=O)c1ccn(C(C)C)n1
452625,Cc1cn(CC(=O)Nc2cn(C(C)(C)C)nc2)nc1,262.16624,[M+H]+,20.0,val,Cc1cnn(CC(=O)Nc2cnn(C(C)(C)C)c2)c1
452626,Cc1cn(CC(=O)Nc2cn(C(C)(C)C)nc2)nc1,262.16624,[M+H]+,20.0,val,Cc1cnn(CC(=O)Nc2cnn(C(C)(C)C)c2)c1
452627,Cc1cn(CC(=O)Nc2cn(C(C)(C)C)nc2)nc1,262.16624,[M+H]+,60.0,val,Cc1cnn(CC(=O)Nc2cnn(C(C)(C)C)c2)c1
452628,Cc1cn(CC(=O)Nc2cn(C(C)(C)C)nc2)nc1,262.16624,[M+H]+,15.0,val,Cc1cnn(CC(=O)Nc2cnn(C(C)(C)C)c2)c1
452629,Cc1cn(CC(=O)Nc2cn(C(C)(C)C)nc2)nc1,262.16624,[M+H]+,20.0,val,Cc1cnn(CC(=O)Nc2cnn(C(C)(C)C)c2)c1
452630,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,20.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452631,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,20.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452632,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,30.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452633,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,60.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452634,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,20.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452635,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,45.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452636,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,60.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452637,COC1CC(Nc2c3cnn(C)c3ncn2)C1(C)C,262.16624,[M+H]+,20.0,val,COC1CC(Nc2ncnc3c2cnn3C)C1(C)C
452638,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,20.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452639,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,20.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452640,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,60.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452641,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,20.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452642,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,45.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452643,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,60.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452644,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,20.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452645,CCn1cnc2c(NC3CCC(O)CC3)ncnc21,262.16624,[M+H]+,45.0,val,CCn1cnc2c(NC3CCC(O)CC3)ncnc21
452646,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,304.15275,[M-H]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452647,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,304.15275,[M-H]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452648,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,304.15275,[M-H]-,60.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452649,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,304.15275,[M-H]-,30.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452650,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,304.15275,[M-H]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452651,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,340.12942,[M+Cl]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452652,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,340.12942,[M+Cl]-,15.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452653,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,350.15823,[M+FA]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452654,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,350.15823,[M+FA]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452655,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,350.15823,[M+FA]-,60.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452656,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,350.15823,[M+FA]-,15.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452657,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,350.15823,[M+FA]-,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452658,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,306.1673,[M+H]+,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452659,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,306.1673,[M+H]+,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452660,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,306.1673,[M+H]+,60.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452661,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,306.1673,[M+H]+,15.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452662,COCc1nn2CC(NC(=O)Nc3cn(C)nc3)CCc2n1,306.1673,[M+H]+,20.0,val,COCc1nc2n(n1)CC(NC(=O)Nc1cnn(C)c1)CC2
452663,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,20.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452664,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,20.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452665,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,60.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452666,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,30.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452667,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,20.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452668,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,30.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452669,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,60.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452670,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1,306.1673,[M+H]+,20.0,val,CCOc1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)nn1
452671,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,20.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452672,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,20.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452673,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,60.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452674,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,30.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452675,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,20.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452676,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,60.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452677,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,30.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452678,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1,322.14445,[M+H]+,20.0,val,CN(C)c1nc(CNC(=O)Nc2cccs2)nc(N(C)C)n1
452679,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,236.12922,[M-H]-,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452680,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,236.12922,[M-H]-,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452681,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,236.12922,[M-H]-,60.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452682,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,236.12922,[M-H]-,30.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452683,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,236.12922,[M-H]-,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452684,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452685,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452686,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452687,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452688,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,45.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452689,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452690,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,236.12922,[M-H]-,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452691,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452692,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452693,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,30.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452694,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452695,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,15.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452696,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452697,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452698,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452699,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452700,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452701,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,30.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452702,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452703,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,15.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452704,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452705,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,60.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452706,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2,238.14377,[M+H]+,20.0,val,O=C(O)CNC(=O)C12CC3CC(CC(C3)C1)C2
452707,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,220.13321,[M+H-H2O]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452708,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,220.13321,[M+H-H2O]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452709,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,220.13321,[M+H-H2O]+,60.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452710,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,220.13321,[M+H-H2O]+,30.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452711,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,220.13321,[M+H-H2O]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452712,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452713,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452714,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,60.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452715,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,30.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452716,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452717,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,60.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452718,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,30.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452719,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1,238.14377,[M+H]+,20.0,val,O=C(O)C1(C(=O)N2CC3CCCCC3C2)CC1
452720,O=C(O)c1c(CN2CCCCCC2CO)ccs1,268.10129,[M-H]-,15.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452721,O=C(O)c1c(CN2CCCCCC2CO)ccs1,268.10129,[M-H]-,15.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452722,O=C(O)c1c(CN2CCCCCC2CO)ccs1,268.10129,[M-H]-,20.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452723,O=C(O)c1c(CN2CCCCCC2CO)ccs1,268.10129,[M-H]-,60.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452724,O=C(O)c1c(CN2CCCCCC2CO)ccs1,268.10129,[M-H]-,15.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452725,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,20.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452726,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,20.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452727,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,60.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452728,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,20.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452729,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,45.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452730,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,60.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452731,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,20.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452732,O=C(O)c1c(CN2CCCCCC2CO)ccs1,270.11584,[M+H]+,45.0,val,O=C(O)c1sccc1CN1CCCCCC1CO
452733,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,300.07336,[M-H]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452734,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,300.07336,[M-H]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452735,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,300.07336,[M-H]-,60.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452736,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,300.07336,[M-H]-,30.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452737,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,300.07336,[M-H]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452738,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,346.07884,[M+FA]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452739,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,346.07884,[M+FA]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452740,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,346.07884,[M+FA]-,60.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452741,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,346.07884,[M+FA]-,15.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452742,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,346.07884,[M+FA]-,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452743,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452744,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452745,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,60.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452746,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,30.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452747,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452748,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,30.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452749,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452750,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,284.07735,[M+H-H2O]+,60.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452751,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,302.08791,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452752,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,302.08791,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452753,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,302.08791,[M+H]+,60.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452754,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,302.08791,[M+H]+,15.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452755,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1,302.08791,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2(O)CSCCSC2)c(C)o1
452756,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,20.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452757,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,20.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452758,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,60.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452759,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,30.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452760,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,20.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452761,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,30.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452762,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,60.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452763,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1,313.11513,[M+H]+,20.0,val,Cc1nnc(N2CCCC(C(=O)N3CCSCC3)C2)s1
452764,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,20.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452765,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,20.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452766,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,60.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452767,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,30.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452768,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,20.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452769,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,60.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452770,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,30.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452771,CCC(CC)Nc1c2nnn(CC3CC3)c2ncn1,261.18222,[M+H]+,20.0,val,CCC(CC)Nc1ncnc2c1nnn2CC1CC1
452772,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,20.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452773,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,20.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452774,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,30.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452775,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,60.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452776,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,15.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452777,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,20.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452778,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,60.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452779,CNCc1cn(Cc2nn(C3CCCC3)cc2)nn1,261.18222,[M+H]+,20.0,val,CNCc1cn(Cc2ccn(C3CCCC3)n2)nn1
452780,CN(CC1CCNCC1)c1c2cnn(C)c2ncn1,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452781,CN(CC1CCNCC1)c1c2cnn(C)c2ncn1,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452782,CN(CC1CCNCC1)c1c2cnn(C)c2ncn1,261.18222,[M+H]+,60.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452783,CN(CC1CCNCC1)c1c2cnn(C)c2ncn1,261.18222,[M+H]+,30.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452784,CN(CC1CCNCC1)c1c2cnn(C)c2ncn1,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452785,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452786,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452787,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,60.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452788,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,30.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452789,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452790,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,30.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452791,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,20.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452792,CN(CC1CCNCC1)c1ncnc2c1cnn2C,261.18222,[M+H]+,60.0,val,CN(CC1CCNCC1)c1ncnc2c1cnn2C
452793,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,20.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452794,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,20.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452795,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,60.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452796,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,30.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452797,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,20.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452798,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,60.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452799,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,30.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452800,COCC1(CNc2cc(C)nc3ncnn23)CCCN1,277.17713,[M+H]+,20.0,val,COCC1(CNc2cc(C)nc3ncnn23)CCCN1
452801,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452802,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452803,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,60.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452804,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,30.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452805,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452806,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,60.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452807,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,30.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452808,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,291.1575,[M-H]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452809,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,327.13418,[M+Cl]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452810,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,327.13418,[M+Cl]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452811,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,327.13418,[M+Cl]-,60.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452812,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,327.13418,[M+Cl]-,15.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452813,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,327.13418,[M+Cl]-,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452814,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,293.17205,[M+H]+,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452815,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,293.17205,[M+H]+,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452816,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,293.17205,[M+H]+,60.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452817,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,293.17205,[M+H]+,15.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452818,CNC(=O)CN1CCN(C(=O)Nc2c(C)nncc2)CC1,293.17205,[M+H]+,20.0,val,CNC(=O)CN1CCN(C(=O)Nc2ccnnc2C)CC1
452819,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452820,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,60.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452821,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,15.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452822,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452823,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,60.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452824,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,15.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452825,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O,269.13945,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)O
452826,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452827,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452828,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,60.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452829,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,30.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452830,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452831,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,60.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452832,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,30.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452833,CC(=O)C(C)CCCCCC1C=CC(=O)O1,225.14852,[M+H]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452834,CC(=O)C(C)CCCCCC1C=CC(=O)O1,242.17507,[M+NH4]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452835,CC(=O)C(C)CCCCCC1C=CC(=O)O1,242.17507,[M+NH4]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452836,CC(=O)C(C)CCCCCC1C=CC(=O)O1,242.17507,[M+NH4]+,60.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452837,CC(=O)C(C)CCCCCC1C=CC(=O)O1,242.17507,[M+NH4]+,15.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452838,CC(=O)C(C)CCCCCC1C=CC(=O)O1,242.17507,[M+NH4]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452839,CC(=O)C(C)CCCCCC1C=CC(=O)O1,247.13046,[M+Na]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452840,CC(=O)C(C)CCCCCC1C=CC(=O)O1,247.13046,[M+Na]+,60.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452841,CC(=O)C(C)CCCCCC1C=CC(=O)O1,247.13046,[M+Na]+,30.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452842,CC(=O)C(C)CCCCCC1C=CC(=O)O1,247.13046,[M+Na]+,20.0,val,CC(=O)C(C)CCCCCC1C=CC(=O)O1
452843,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,20.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452844,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,20.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452845,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,30.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452846,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,60.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452847,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,15.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452848,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,20.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452849,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,60.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452850,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1,280.15904,[M+H]+,20.0,val,Cc1nn(C)c(C)c1CNc1nc(C(C)(C)C)ns1
452851,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452852,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452853,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,60.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452854,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,30.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452855,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452856,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,60.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452857,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,30.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452858,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,345.14157,[M-H]-,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452859,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452860,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452861,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,60.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452862,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,30.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452863,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452864,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,60.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452865,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,30.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452866,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO,347.15612,[M+H]+,20.0,val,CO[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO
452867,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,403.14053,[M+FA]-,20.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452868,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,403.14053,[M+FA]-,60.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452869,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,403.14053,[M+FA]-,15.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452870,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,403.14053,[M+FA]-,20.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452871,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,359.1496,[M+H]+,20.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452872,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,359.1496,[M+H]+,20.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452873,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,359.1496,[M+H]+,60.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452874,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,359.1496,[M+H]+,30.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452875,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1,359.1496,[M+H]+,20.0,val,O=C(CCn1cncn1)N1CCN(S(=O)(=O)N2CCOCC2)CC1
452876,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O,271.1551,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O
452877,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O,271.1551,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O
452878,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O,271.1551,[M+FA]-,60.0,val,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O
452879,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O,271.1551,[M+FA]-,15.0,val,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O
452880,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O,271.1551,[M+FA]-,20.0,val,CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O
452881,CCC(C)(O)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452882,CCC(C)(O)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452883,CCC(C)(O)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,60.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452884,CCC(C)(O)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,15.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452885,CCC(C)(O)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452886,CCC(C)(O)CCCCCC1C=CC(=O)O1,249.14611,[M+Na]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452887,CCC(C)(O)CCCCCC1C=CC(=O)O1,249.14611,[M+Na]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452888,CCC(C)(O)CCCCCC1C=CC(=O)O1,249.14611,[M+Na]+,60.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452889,CCC(C)(O)CCCCCC1C=CC(=O)O1,249.14611,[M+Na]+,30.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452890,CCC(C)(O)CCCCCC1C=CC(=O)O1,249.14611,[M+Na]+,20.0,val,CCC(C)(O)CCCCCC1C=CC(=O)O1
452891,CC(O)C(C)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452892,CC(O)C(C)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452893,CC(O)C(C)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,60.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452894,CC(O)C(C)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,15.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452895,CC(O)C(C)CCCCCC1C=CC(=O)O1,209.15361,[M+H-H2O]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452896,CC(O)C(C)CCCCCC1C=CC(=O)O1,227.16417,[M+H]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452897,CC(O)C(C)CCCCCC1C=CC(=O)O1,227.16417,[M+H]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452898,CC(O)C(C)CCCCCC1C=CC(=O)O1,227.16417,[M+H]+,60.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452899,CC(O)C(C)CCCCCC1C=CC(=O)O1,227.16417,[M+H]+,30.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452900,CC(O)C(C)CCCCCC1C=CC(=O)O1,227.16417,[M+H]+,20.0,val,CC(O)C(C)CCCCCC1C=CC(=O)O1
452901,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452902,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452903,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,60.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452904,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,30.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452905,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452906,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,60.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452907,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,30.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452908,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1,286.15837,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)NC2CCCC2(C)C)c1
452909,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,240.16052,[M-H]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452910,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,240.16052,[M-H]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452911,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,240.16052,[M-H]-,60.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452912,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,240.16052,[M-H]-,30.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452913,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,240.16052,[M-H]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452914,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,286.166,[M+FA]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452915,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,286.166,[M+FA]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452916,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,286.166,[M+FA]-,60.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452917,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,286.166,[M+FA]-,15.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452918,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,286.166,[M+FA]-,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452919,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,224.16451,[M+H-H2O]+,30.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452920,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,224.16451,[M+H-H2O]+,30.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452921,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,224.16451,[M+H-H2O]+,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452922,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,224.16451,[M+H-H2O]+,60.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452923,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,224.16451,[M+H-H2O]+,30.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452924,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,242.17507,[M+H]+,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452925,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,242.17507,[M+H]+,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452926,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,242.17507,[M+H]+,60.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452927,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,242.17507,[M+H]+,15.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452928,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC,242.17507,[M+H]+,20.0,val,C/C=C/C=C(\C)C(=O)NC(CO)C(C)(O)CC
452929,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452930,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452931,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,60.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452932,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,30.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452933,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452934,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,60.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452935,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,30.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452936,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,315.14964,[M-H]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452937,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,361.15511,[M+FA]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452938,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,361.15511,[M+FA]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452939,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,361.15511,[M+FA]-,60.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452940,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,361.15511,[M+FA]-,15.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452941,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,361.15511,[M+FA]-,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452942,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,317.16419,[M+H]+,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452943,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,317.16419,[M+H]+,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452944,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,317.16419,[M+H]+,60.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452945,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,317.16419,[M+H]+,30.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452946,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1,317.16419,[M+H]+,20.0,val,CCC(CC)C1CC(NS(=O)(=O)c2cn(C)nn2)CCO1
452947,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452948,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452949,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452950,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452951,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452952,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452953,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452954,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452955,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452956,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452957,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452958,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452959,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452960,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452961,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452962,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1,317.16419,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
452963,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,299.17248,[M-H]-,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452964,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,299.17248,[M-H]-,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452965,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,299.17248,[M-H]-,60.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452966,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,299.17248,[M-H]-,15.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452967,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,299.17248,[M-H]-,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452968,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452969,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452970,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,30.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452971,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,60.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452972,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,15.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452973,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452974,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,60.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452975,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1,301.18703,[M+H]+,20.0,val,CCCCNC(=O)NC(=O)CN1CCCC(O)(C(N)=O)C1
452976,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452977,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452978,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,60.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452979,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,30.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452980,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452981,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,60.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452982,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,30.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452983,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1,306.18459,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N2CCCN(CCO)CC2)CC1
452984,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.02022,[M]-,20.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452985,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.02022,[M]-,20.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452986,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.02022,[M]-,60.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452987,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.02022,[M]-,45.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452988,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.01967,[M]-,20.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452989,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.01967,[M]-,20.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452990,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.01967,[M]-,60.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452991,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.01967,[M]-,20.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452992,N#Cc1c(C#N)nc2-c3cc(F)c(F)cc3C(=O)c2n1,268.01967,[M]-,60.0,val,N#Cc1nc2c(nc1C#N)-c1cc(F)c(F)cc1C2=O
452993,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,20.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452994,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,20.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452995,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,60.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452996,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,30.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452997,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,20.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452998,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,60.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
452999,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,30.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
453000,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1,524.83482,[M-H]-,20.0,val,Cc1nc(C(F)(F)F)c(C(=O)Nc2c(Br)cc(OC(F)(F)F)cc2Br)s1
453001,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453002,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453003,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,60.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453004,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,30.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453005,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453006,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,60.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453007,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,30.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453008,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453009,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453010,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453011,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,60.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453012,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,30.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453013,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453014,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,45.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453015,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,60.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453016,O=C(Nc1c(Cl)cc([N+](=O)[O-])cc1)c1c(O)ccc(Cl)c1,324.97884,[M-H]-,20.0,val,O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O
453017,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,299.02045,[M-H]-,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453018,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,299.02045,[M-H]-,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453019,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,299.02045,[M-H]-,45.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453020,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,299.02045,[M-H]-,60.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453021,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,299.02045,[M-H]-,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453022,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,301.035,[M+H]+,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453023,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,301.035,[M+H]+,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453024,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,301.035,[M+H]+,45.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453025,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,301.035,[M+H]+,60.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453026,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1,301.035,[M+H]+,20.0,val,O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccncc1
453027,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,20.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453028,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,20.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453029,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,60.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453030,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,20.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453031,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,45.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453032,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,60.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453033,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,20.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453034,Cc1nnc2sc(-c3c(C(F)(F)F)n(-c4ccccn4)nc3)nn12,352.05867,[M+H]+,45.0,val,Cc1nnc2sc(-c3cnn(-c4ccccn4)c3C(F)(F)F)nn12
453035,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,20.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453036,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,60.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453037,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,30.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453038,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,20.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453039,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,20.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453040,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,60.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453041,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,30.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453042,O=C(O)c1ccc(-c2cc(Br)ccc2)cc1,274.97132,[M-H]-,20.0,val,O=C(O)c1ccc(-c2cccc(Br)c2)cc1
453043,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,20.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453044,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,20.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453045,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,60.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453046,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,30.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453047,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,20.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453048,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,60.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453049,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,30.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453050,O=C(O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1,354.97971,[M-H]-,20.0,val,O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1
453051,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453052,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453053,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453054,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,30.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453055,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453056,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453057,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453058,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453059,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453060,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,45.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453061,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453062,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453063,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,45.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453064,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453065,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453066,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453067,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,30.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453068,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453069,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453070,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,30.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453071,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,281.05434,[M-H]-,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453072,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453073,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453074,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453075,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453076,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,45.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453077,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,60.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453078,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,20.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453079,O=C(O)c1c(Nc2cccc(C(F)(F)F)c2)nccc1,283.06889,[M+H]+,45.0,val,O=C(O)c1cccnc1Nc1cccc(C(F)(F)F)c1
453080,CCOC(=O)c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453081,CCOC(=O)c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453082,CCOC(=O)c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1,343.04711,[M+H]+,60.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453083,CCOC(=O)c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1,343.04711,[M+H]+,30.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453084,CCOC(=O)c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453085,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453086,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453087,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1,343.04711,[M+H]+,60.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453088,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1,343.04711,[M+H]+,30.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453089,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1,343.04711,[M+H]+,20.0,val,CCOC(=O)c1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1
453090,Cc1c(Oc2c3sccc3ncn2)cc([N+](=O)[O-])cc1,288.04374,[M+H]+,20.0,val,Cc1ccc([N+](=O)[O-])cc1Oc1ncnc2ccsc12
453091,Cc1c(Oc2c3sccc3ncn2)cc([N+](=O)[O-])cc1,288.04374,[M+H]+,20.0,val,Cc1ccc([N+](=O)[O-])cc1Oc1ncnc2ccsc12
453092,Cc1c(Oc2c3sccc3ncn2)cc([N+](=O)[O-])cc1,288.04374,[M+H]+,60.0,val,Cc1ccc([N+](=O)[O-])cc1Oc1ncnc2ccsc12
453093,Cc1c(Oc2c3sccc3ncn2)cc([N+](=O)[O-])cc1,288.04374,[M+H]+,20.0,val,Cc1ccc([N+](=O)[O-])cc1Oc1ncnc2ccsc12
453094,Cc1c(Oc2c3sccc3ncn2)cc([N+](=O)[O-])cc1,288.04374,[M+H]+,45.0,val,Cc1ccc([N+](=O)[O-])cc1Oc1ncnc2ccsc12
453095,O=C(Nc1ccccc1)c1nc(-c2ncncc2)no1,266.06835,[M-H]-,20.0,val,O=C(Nc1ccccc1)c1nc(-c2ccncn2)no1
453096,O=C(Nc1ccccc1)c1nc(-c2ncncc2)no1,266.06835,[M-H]-,60.0,val,O=C(Nc1ccccc1)c1nc(-c2ccncn2)no1
453097,O=C(Nc1ccccc1)c1nc(-c2ncncc2)no1,266.06835,[M-H]-,15.0,val,O=C(Nc1ccccc1)c1nc(-c2ccncn2)no1
453098,O=C(Nc1ccccc1)c1nc(-c2ncncc2)no1,266.06835,[M-H]-,20.0,val,O=C(Nc1ccccc1)c1nc(-c2ccncn2)no1
453099,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453100,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453101,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453102,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,30.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453103,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453104,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453105,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,30.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453106,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453107,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453108,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453109,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,316.04989,[M+H]+,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453110,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,316.04989,[M+H]+,15.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453111,O=C1Nc2c3c1cccc3c(S(=O)(=O)Nc1ncn[nH]1)cc2,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453112,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453113,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453114,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453115,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,30.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453116,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453117,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,30.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453118,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453119,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,314.03533,[M-H]-,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453120,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453121,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453122,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,316.04989,[M+H]+,60.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453123,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,316.04989,[M+H]+,15.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453124,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23,316.04989,[M+H]+,20.0,val,O=C1Nc2ccc(S(=O)(=O)Nc3ncn[nH]3)c3cccc1c23
453125,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1cc2c(cc1)OCCO2,377.99723,[M-H]-,20.0,val,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc2c(c1)OCCO2
453126,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1cc2c(cc1)OCCO2,377.99723,[M-H]-,20.0,val,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc2c(c1)OCCO2
453127,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1cc2c(cc1)OCCO2,377.99723,[M-H]-,60.0,val,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc2c(c1)OCCO2
453128,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1cc2c(cc1)OCCO2,377.99723,[M-H]-,15.0,val,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc2c(c1)OCCO2
453129,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1cc2c(cc1)OCCO2,377.99723,[M-H]-,20.0,val,O=c1[nH]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc2c(c1)OCCO2
453130,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453131,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453132,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,60.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453133,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453134,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,45.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453135,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,60.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453136,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453137,Cc1c(C)c2c([nH]c(=O)n(-c3cc(Cl)c(Cl)cc3)c2=O)s1,338.97673,[M-H]-,45.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453138,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453139,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453140,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,45.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453141,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,60.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453142,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453143,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,45.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453144,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,20.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453145,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C,338.97673,[M-H]-,60.0,val,Cc1sc2[nH]c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)c2c1C
453146,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453147,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453148,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,60.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453149,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,15.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453150,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453151,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,15.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453152,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453153,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,338.97673,[M-H]-,60.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453154,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,340.99128,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453155,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,340.99128,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453156,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,340.99128,[M+H]+,60.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453157,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,340.99128,[M+H]+,30.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453158,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12,340.99128,[M+H]+,20.0,val,Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)O)cc12
453159,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,302.01603,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453160,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,302.01603,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453161,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,302.01603,[M-H]-,60.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453162,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,302.01603,[M-H]-,15.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453163,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,302.01603,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453164,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,20.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453165,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,20.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453166,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,45.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453167,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,60.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453168,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,20.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453169,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,45.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453170,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,60.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453171,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1,304.03059,[M+H]+,20.0,val,O=C(CSc1nnc2ccccn12)c1ccc(Cl)cc1
453172,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,304.03059,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453173,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,304.03059,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453174,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,304.03059,[M+H]+,60.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453175,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,304.03059,[M+H]+,30.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453176,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl,304.03059,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)Nc1ccccc1Cl
453177,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,346.0171,[M-H]-,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453178,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,346.0171,[M-H]-,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453179,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,346.0171,[M-H]-,60.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453180,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,346.0171,[M-H]-,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453181,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,348.03165,[M+H]+,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453182,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,348.03165,[M+H]+,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453183,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,348.03165,[M+H]+,60.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453184,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,348.03165,[M+H]+,20.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453185,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1,348.03165,[M+H]+,45.0,val,Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1
453186,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,20.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453187,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,20.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453188,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,60.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453189,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,15.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453190,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,20.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453191,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,20.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453192,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,15.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453193,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1,306.09611,[M+H]+,60.0,val,FC(F)(F)c1cccc(-n2cccc2/C=N/n2cnnc2)c1
453194,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,357.06163,[M-H]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453195,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,357.06163,[M-H]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453196,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,357.06163,[M-H]-,60.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453197,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,357.06163,[M-H]-,15.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453198,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,357.06163,[M-H]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453199,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,393.0383,[M+Cl]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453200,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,393.0383,[M+Cl]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453201,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,393.0383,[M+Cl]-,60.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453202,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,393.0383,[M+Cl]-,15.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453203,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1,393.0383,[M+Cl]-,20.0,val,O=c1onc(Cc2ccc(F)cc2)n1Cc1nc(CC(F)(F)F)no1
453204,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453205,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453206,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453207,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453208,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453209,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453210,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453211,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453212,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,286.04449,[M+H-H2O]+,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453213,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,286.04449,[M+H-H2O]+,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453214,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,286.04449,[M+H-H2O]+,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453215,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,286.04449,[M+H-H2O]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453216,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,286.04449,[M+H-H2O]+,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453217,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453218,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453219,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,304.05505,[M+H]+,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453220,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,304.05505,[M+H]+,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453221,Cc1cnc(NC(=O)c2c[nH]c3c(cccc3F)c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453222,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453223,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453224,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,60.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453225,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,30.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453226,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453227,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,30.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453228,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453229,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,302.0405,[M-H]-,60.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453230,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453231,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453232,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,45.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453233,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453234,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453235,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,45.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453236,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453237,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,302.0405,[M-H]-,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453238,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,304.05505,[M+H]+,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453239,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,304.05505,[M+H]+,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453240,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,304.05505,[M+H]+,60.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453241,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,304.05505,[M+H]+,30.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453242,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1,304.05505,[M+H]+,20.0,val,O=C(Nc1nnc(Cc2cccs2)o1)c1ccc(F)cc1
453243,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453244,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453245,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,304.05505,[M+H]+,60.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453246,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,304.05505,[M+H]+,30.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453247,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1,304.05505,[M+H]+,20.0,val,Cc1cnc(NC(=O)c2c[nH]c3c(F)cccc3c2=O)s1
453248,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453249,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453250,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,60.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453251,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453252,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,60.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453253,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,273.04046,[M-H]-,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453254,COc1c2oc3c(ccc(O)c3)c(=O)c2c(O)cc1O,273.04046,[M-H]-,20.0,val,COc1c(O)cc(O)c2c(=O)c3ccc(O)cc3oc12
453255,COc1c2oc3c(ccc(O)c3)c(=O)c2c(O)cc1O,273.04046,[M-H]-,20.0,val,COc1c(O)cc(O)c2c(=O)c3ccc(O)cc3oc12
453256,COc1c2oc3c(ccc(O)c3)c(=O)c2c(O)cc1O,273.04046,[M-H]-,60.0,val,COc1c(O)cc(O)c2c(=O)c3ccc(O)cc3oc12
453257,COc1c2oc3c(ccc(O)c3)c(=O)c2c(O)cc1O,273.04046,[M-H]-,30.0,val,COc1c(O)cc(O)c2c(=O)c3ccc(O)cc3oc12
453258,COc1c2oc3c(ccc(O)c3)c(=O)c2c(O)cc1O,273.04046,[M-H]-,20.0,val,COc1c(O)cc(O)c2c(=O)c3ccc(O)cc3oc12
453259,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453260,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453261,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,60.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453262,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453263,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,45.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453264,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,60.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453265,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,20.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453266,Cc1c2c(=O)c3c(O)cc(O)cc3oc2cc(O)c1O,275.05501,[M+H]+,45.0,val,Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
453267,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453268,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453269,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,45.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453270,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,60.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453271,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453272,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453273,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,45.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453274,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1,273.04046,[M-H]-,60.0,val,COc1cc(O)c2c(=O)c3c(O)ccc(O)c3oc2c1
453275,O=C1NC(c2cccc(Br)c2)Nc2ccccc21,303.01275,[M+H]+,20.0,val,O=C1NC(c2cccc(Br)c2)Nc2ccccc21
453276,O=C1NC(c2cccc(Br)c2)Nc2ccccc21,303.01275,[M+H]+,20.0,val,O=C1NC(c2cccc(Br)c2)Nc2ccccc21
453277,O=C1NC(c2cccc(Br)c2)Nc2ccccc21,303.01275,[M+H]+,45.0,val,O=C1NC(c2cccc(Br)c2)Nc2ccccc21
453278,O=C1NC(c2cccc(Br)c2)Nc2ccccc21,303.01275,[M+H]+,60.0,val,O=C1NC(c2cccc(Br)c2)Nc2ccccc21
453279,O=C1NC(c2cccc(Br)c2)Nc2ccccc21,303.01275,[M+H]+,20.0,val,O=C1NC(c2cccc(Br)c2)Nc2ccccc21
453280,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12,334.98482,[M+H]+,20.0,val,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12
453281,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12,334.98482,[M+H]+,20.0,val,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12
453282,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12,334.98482,[M+H]+,60.0,val,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12
453283,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12,334.98482,[M+H]+,30.0,val,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12
453284,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12,334.98482,[M+H]+,20.0,val,O=C(NC1=NCCS1)c1cccc2c(Br)cccc12
453285,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1,334.98482,[M+H]+,20.0,val,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1
453286,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1,334.98482,[M+H]+,20.0,val,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1
453287,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1,334.98482,[M+H]+,45.0,val,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1
453288,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1,334.98482,[M+H]+,60.0,val,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1
453289,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1,334.98482,[M+H]+,20.0,val,Cc1sc2ncn(C)c(=O)c2c1-c1ccc(Br)cc1
453290,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1,316.97536,[M-H]-,20.0,val,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1
453291,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1,316.97536,[M-H]-,20.0,val,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1
453292,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1,316.97536,[M-H]-,45.0,val,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1
453293,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1,316.97536,[M-H]-,60.0,val,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1
453294,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1,316.97536,[M-H]-,20.0,val,S=c1[nH]c2cc(Br)ccc2n1Cc1ccccc1
453295,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,20.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453296,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,20.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453297,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,60.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453298,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,30.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453299,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,20.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453300,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,60.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453301,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,30.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453302,Brc1ccc(SCc2cn3ccccc3n2)cc1,318.98991,[M+H]+,20.0,val,Brc1ccc(SCc2cn3ccccc3n2)cc1
453303,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453304,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453305,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,60.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453306,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,15.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453307,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453308,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453309,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453310,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,60.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453311,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,30.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453312,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453313,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453314,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453315,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,60.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453316,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,15.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453317,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453318,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,60.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453319,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,15.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453320,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,305.03346,[M-H]-,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453321,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453322,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453323,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,60.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453324,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,30.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453325,O=C(O)CNC(=O)c1c(O)cc(-c2cc(Cl)ccc2)cn1,307.04801,[M+H]+,20.0,val,O=C(O)CNC(=O)c1ncc(-c2cccc(Cl)c2)cc1O
453326,O=C(NCc1cc(Cl)ccc1)c1nn2cccnc2c1,287.06941,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cc2ncccn2n1
453327,O=C(NCc1cc(Cl)ccc1)c1nn2cccnc2c1,287.06941,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cc2ncccn2n1
453328,O=C(NCc1cc(Cl)ccc1)c1nn2cccnc2c1,287.06941,[M+H]+,60.0,val,O=C(NCc1cccc(Cl)c1)c1cc2ncccn2n1
453329,O=C(NCc1cc(Cl)ccc1)c1nn2cccnc2c1,287.06941,[M+H]+,30.0,val,O=C(NCc1cccc(Cl)c1)c1cc2ncccn2n1
453330,O=C(NCc1cc(Cl)ccc1)c1nn2cccnc2c1,287.06941,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cc2ncccn2n1
453331,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,295.06999,[M-H]-,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453332,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,295.06999,[M-H]-,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453333,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,295.06999,[M-H]-,60.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453334,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,295.06999,[M-H]-,30.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453335,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,295.06999,[M-H]-,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453336,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,297.08454,[M+H]+,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453337,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,297.08454,[M+H]+,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453338,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,297.08454,[M+H]+,60.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453339,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,297.08454,[M+H]+,20.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453340,Cc1c(C(F)(F)F)cccc1Nc1c(C(=O)O)cccn1,297.08454,[M+H]+,45.0,val,Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
453341,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453342,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453343,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,60.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453344,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453345,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,45.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453346,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,60.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453347,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453348,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,328.02033,[M-H]-,45.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453349,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,330.03488,[M+H]+,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453350,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,330.03488,[M+H]+,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453351,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,330.03488,[M+H]+,60.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453352,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,330.03488,[M+H]+,20.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453353,CNc1ncc2ncnc(Nc3cc(Br)ccc3)c2c1,330.03488,[M+H]+,60.0,val,CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1
453354,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,20.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453355,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,20.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453356,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,45.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453357,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,60.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453358,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,20.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453359,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,45.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453360,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,20.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453361,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1,330.03488,[M+H]+,60.0,val,Brc1ccccc1Nc1ncnc2c1ncn2C1CC1
453362,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1,330.03488,[M+H]+,20.0,val,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1
453363,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1,330.03488,[M+H]+,20.0,val,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1
453364,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1,330.03488,[M+H]+,60.0,val,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1
453365,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1,330.03488,[M+H]+,30.0,val,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1
453366,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1,330.03488,[M+H]+,20.0,val,Brc1cnc(N2CC(n3cnc4ccccc43)C2)nc1
453367,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C,322.00733,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C
453368,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C,322.00733,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C
453369,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C,322.00733,[M+H]+,60.0,val,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C
453370,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C,322.00733,[M+H]+,30.0,val,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C
453371,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C,322.00733,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccccc2Br)cc(=O)n1C
453372,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453373,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453374,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,60.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453375,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,30.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453376,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453377,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,60.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453378,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453379,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,335.98769,[M-H]-,30.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453380,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,381.99317,[M+FA]-,15.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453381,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,381.99317,[M+FA]-,15.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453382,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,381.99317,[M+FA]-,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453383,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,381.99317,[M+FA]-,60.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453384,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,381.99317,[M+FA]-,15.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453385,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1,338.00225,[M+H]+,20.0,val,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1
453386,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1,338.00225,[M+H]+,20.0,val,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1
453387,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1,338.00225,[M+H]+,60.0,val,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1
453388,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1,338.00225,[M+H]+,30.0,val,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1
453389,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1,338.00225,[M+H]+,20.0,val,CCC(=O)Nc1ccc(OC(=O)c2ccc(Br)o2)cc1
453390,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,338.00225,[M+H]+,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453391,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,338.00225,[M+H]+,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453392,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,338.00225,[M+H]+,60.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453393,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,338.00225,[M+H]+,30.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453394,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1,338.00225,[M+H]+,20.0,val,O=C(CCc1ccco1)Nc1cc(Br)cc(C(=O)O)c1
453395,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,337.02645,[M-H]-,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453396,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,337.02645,[M-H]-,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453397,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,337.02645,[M-H]-,60.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453398,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,337.02645,[M-H]-,30.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453399,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,337.02645,[M-H]-,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453400,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,383.03193,[M+FA]-,30.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453401,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,383.03193,[M+FA]-,30.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453402,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,383.03193,[M+FA]-,60.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453403,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,383.03193,[M+FA]-,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453404,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,383.03193,[M+FA]-,30.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453405,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,339.04101,[M+H]+,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453406,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,339.04101,[M+H]+,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453407,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,339.04101,[M+H]+,60.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453408,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,339.04101,[M+H]+,30.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453409,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1,339.04101,[M+H]+,20.0,val,O=C(NCCNC(=O)c1ccc(Cl)cc1Cl)c1cnccn1
453410,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453411,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453412,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453413,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453414,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,45.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453415,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453416,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453417,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,343.0579,[M-H]-,45.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453418,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,379.03457,[M+Cl]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453419,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,379.03457,[M+Cl]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453420,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,379.03457,[M+Cl]-,60.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453421,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,379.03457,[M+Cl]-,15.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453422,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,379.03457,[M+Cl]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453423,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,389.06338,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453424,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,389.06338,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453425,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,389.06338,[M+FA]-,60.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453426,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,389.06338,[M+FA]-,15.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453427,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,389.06338,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453428,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,345.07245,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453429,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,345.07245,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453430,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,345.07245,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453431,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,345.07245,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453432,O=C(Nc1ccc(Cl)cc1)c1c2NCCC(C(F)(F)F)n2nc1,345.07245,[M+H]+,45.0,val,O=C(Nc1ccc(Cl)cc1)c1cnn2c1NCCC2C(F)(F)F
453433,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453434,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453435,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453436,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453437,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453438,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453439,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453440,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,300.06576,[M-H]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453441,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453442,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453443,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453444,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453445,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453446,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453447,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453448,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,336.04244,[M+Cl]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453449,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453450,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453451,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453452,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453453,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453454,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453455,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,15.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453456,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,346.07124,[M+FA]-,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453457,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,302.08031,[M+H]+,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453458,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,302.08031,[M+H]+,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453459,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,302.08031,[M+H]+,60.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453460,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,302.08031,[M+H]+,30.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453461,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21,302.08031,[M+H]+,20.0,val,Cn1nnc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21
453462,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,20.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453463,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,20.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453464,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,60.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453465,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,30.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453466,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,20.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453467,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,60.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453468,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,30.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453469,FC(F)COc1c(-c2noc(CCc3nccs3)n2)cccn1,339.07218,[M+H]+,20.0,val,FC(F)COc1ncccc1-c1noc(CCc2nccs2)n1
453470,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453471,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453472,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,30.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453473,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,60.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453474,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453475,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,45.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453476,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453477,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,337.05763,[M-H]-,60.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453478,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453479,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453480,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,60.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453481,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,30.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453482,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453483,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,60.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453484,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,30.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453485,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1,339.07218,[M+H]+,20.0,val,Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1
453486,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,255.07752,[M-H]-,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453487,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,255.07752,[M-H]-,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453488,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,255.07752,[M-H]-,60.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453489,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,255.07752,[M-H]-,30.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453490,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,255.07752,[M-H]-,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453491,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,257.09207,[M+H]+,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453492,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,257.09207,[M+H]+,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453493,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,257.09207,[M+H]+,60.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453494,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,257.09207,[M+H]+,15.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453495,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1,257.09207,[M+H]+,20.0,val,O=C(O)c1cccc(CNC(=O)c2ccccn2)c1
453496,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453497,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453498,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,60.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453499,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,30.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453500,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453501,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,60.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453502,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,30.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453503,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,255.07752,[M-H]-,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453504,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453505,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453506,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453507,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,30.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453508,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453509,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453510,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,30.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453511,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,255.07752,[M-H]-,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453512,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,239.08151,[M+H-H2O]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453513,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,239.08151,[M+H-H2O]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453514,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,239.08151,[M+H-H2O]+,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453515,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,239.08151,[M+H-H2O]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453516,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,239.08151,[M+H-H2O]+,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453517,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453518,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453519,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453520,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,30.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453521,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453522,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,60.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453523,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,30.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453524,Cc1c(NC(=O)c2ccncc2)c(C(=O)O)ccc1,257.09207,[M+H]+,20.0,val,Cc1cccc(C(=O)O)c1NC(=O)c1ccncc1
453525,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453526,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453527,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,60.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453528,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453529,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,45.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453530,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,60.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453531,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,20.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453532,O=C(O)C1CC1C(=O)Nc1cc2c(cc1)nccc2,257.09207,[M+H]+,45.0,val,O=C(O)C1CC1C(=O)Nc1ccc2ncccc2c1
453533,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,20.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453534,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,20.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453535,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,60.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453536,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,20.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453537,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,45.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453538,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,60.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453539,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,20.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453540,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1,279.09998,[M-H]-,45.0,val,C[C@@H]1CC(=O)NN=C1c1ccc(NN=C(C#N)C#N)cc1
453541,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453542,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453543,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,60.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453544,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,30.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453545,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453546,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,30.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453547,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,60.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453548,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,355.03069,[M-H]-,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453549,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,357.04524,[M+H]+,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453550,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,357.04524,[M+H]+,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453551,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,357.04524,[M+H]+,60.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453552,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,357.04524,[M+H]+,15.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453553,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O,357.04524,[M+H]+,20.0,val,O=C(O)C[C@H](C(=O)O)[C@H]1c2c(cc(O)c(O)c2O)C(=O)O[C@@H]1C(=O)O
453554,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,307.04594,[M-H]-,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453555,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,307.04594,[M-H]-,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453556,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,307.04594,[M-H]-,60.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453557,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,307.04594,[M-H]-,30.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453558,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,307.04594,[M-H]-,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453559,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,291.04993,[M+H-H2O]+,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453560,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,291.04993,[M+H-H2O]+,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453561,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,291.04993,[M+H-H2O]+,60.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453562,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,291.04993,[M+H-H2O]+,30.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453563,CC1(O)Cc2c(CO1)c(=O)c1c(cc(O)c(O)c1C(=O)O)o2,291.04993,[M+H-H2O]+,20.0,val,CC1(O)Cc2oc3cc(O)c(O)c(C(=O)O)c3c(=O)c2CO1
453564,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,334.98592,[M-H]-,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453565,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,334.98592,[M-H]-,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453566,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,334.98592,[M-H]-,60.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453567,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,334.98592,[M-H]-,15.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453568,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,334.98592,[M-H]-,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453569,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,380.9914,[M+FA]-,15.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453570,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,380.9914,[M+FA]-,15.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453571,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,380.9914,[M+FA]-,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453572,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,380.9914,[M+FA]-,60.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453573,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,380.9914,[M+FA]-,15.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453574,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,380.9914,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453575,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,380.9914,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453576,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,380.9914,[M+FA]-,60.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453577,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,337.00047,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453578,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,337.00047,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453579,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,337.00047,[M+H]+,20.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453580,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,337.00047,[M+H]+,60.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453581,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1,337.00047,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1cncc(Br)c1
453582,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,20.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453583,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,20.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453584,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,60.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453585,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,30.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453586,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,20.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453587,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,30.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453588,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,20.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453589,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1,337.00047,[M+H]+,60.0,val,Cc1cc(C)nc(SCC(=O)c2ccc(Br)cc2)n1
453590,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,337.00047,[M+H]+,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453591,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,337.00047,[M+H]+,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453592,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,337.00047,[M+H]+,60.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453593,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,337.00047,[M+H]+,15.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453594,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1,337.00047,[M+H]+,20.0,val,O=C(CCSc1ccccn1)Nc1ccc(Br)cc1
453595,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,324.03121,[M-H]-,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453596,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,324.03121,[M-H]-,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453597,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,324.03121,[M-H]-,60.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453598,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,324.03121,[M-H]-,30.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453599,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,324.03121,[M-H]-,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453600,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,20.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453601,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,20.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453602,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,30.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453603,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,60.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453604,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,15.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453605,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,20.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453606,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,60.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453607,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1,326.04576,[M+H]+,20.0,val,COc1cnc(N(C)C(=O)Cc2c(Cl)cccc2Cl)nc1
453608,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,326.04576,[M+H]+,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453609,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,326.04576,[M+H]+,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453610,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,326.04576,[M+H]+,60.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453611,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,326.04576,[M+H]+,30.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453612,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2c(cn[nH]2)C1,326.04576,[M+H]+,20.0,val,O=C(C(O)c1cc(Cl)cc(Cl)c1)N1CCc2[nH]ncc2C1
453613,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1,326.04576,[M+H]+,20.0,val,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1
453614,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1,326.04576,[M+H]+,20.0,val,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1
453615,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1,326.04576,[M+H]+,60.0,val,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1
453616,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1,326.04576,[M+H]+,30.0,val,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1
453617,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1,326.04576,[M+H]+,20.0,val,Cc1cc(C)nc(NC(=O)COc2ccc(Cl)cc2Cl)n1
453618,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453619,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453620,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,312.01997,[M-H]-,60.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453621,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,312.01997,[M-H]-,15.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453622,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453623,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453624,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453625,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,314.03452,[M+H]+,60.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453626,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,314.03452,[M+H]+,15.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453627,O=C(O)C1CC=CCC1C(=O)Nc1c(Cl)ccc(Cl)c1,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453628,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453629,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453630,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,312.01997,[M-H]-,60.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453631,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,312.01997,[M-H]-,30.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453632,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,312.01997,[M-H]-,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453633,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453634,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453635,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,314.03452,[M+H]+,60.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453636,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,314.03452,[M+H]+,30.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453637,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl,314.03452,[M+H]+,20.0,val,O=C(O)C1CC=CCC1C(=O)Nc1cc(Cl)ccc1Cl
453638,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,20.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453639,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,20.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453640,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,60.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453641,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,20.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453642,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,60.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453643,FC(F)c1nc2ccccc2c(N2CCOC(C(F)F)C2)n1,316.10675,[M+H]+,20.0,val,FC(F)c1nc(N2CCOC(C(F)F)C2)c2ccccc2n1
453644,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453645,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453646,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,60.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453647,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,15.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453648,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453649,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453650,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,15.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453651,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,335.06196,[M-H]-,60.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453652,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,371.03864,[M+Cl]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453653,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,371.03864,[M+Cl]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453654,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,371.03864,[M+Cl]-,60.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453655,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,371.03864,[M+Cl]-,15.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453656,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,371.03864,[M+Cl]-,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453657,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,337.07651,[M+H]+,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453658,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,337.07651,[M+H]+,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453659,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,337.07651,[M+H]+,60.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453660,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,337.07651,[M+H]+,15.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453661,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O,337.07651,[M+H]+,20.0,val,CN1c2ccc(NC(=O)c3cncc(F)c3)cc2N(C)S1(=O)=O
453662,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,254.0935,[M-H]-,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453663,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,254.0935,[M-H]-,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453664,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,254.0935,[M-H]-,60.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453665,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,254.0935,[M-H]-,30.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453666,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,254.0935,[M-H]-,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453667,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,256.10805,[M+H]+,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453668,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,256.10805,[M+H]+,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453669,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,256.10805,[M+H]+,60.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453670,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,256.10805,[M+H]+,30.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453671,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12,256.10805,[M+H]+,20.0,val,CC(=O)N1CC(C#N)C2(C1)C(=O)Nc1ccccc12
453672,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453673,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453674,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,60.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453675,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,30.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453676,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453677,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,60.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453678,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,30.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453679,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,302.06049,[M-H]-,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453680,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,304.07504,[M+H]+,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453681,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,304.07504,[M+H]+,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453682,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,304.07504,[M+H]+,60.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453683,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,304.07504,[M+H]+,30.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453684,O=C(O)C1CC2CCC1N2C(=O)c1c2sccc2ncn1,304.07504,[M+H]+,20.0,val,O=C(O)C1CC2CCC1N2C(=O)c1ncnc2ccsc12
453685,O=C(c1cc2nccnc2cc1)N1CC2CC1CS2(=O)=O,304.07504,[M+H]+,20.0,val,O=C(c1ccc2nccnc2c1)N1CC2CC1CS2(=O)=O
453686,O=C(c1cc2nccnc2cc1)N1CC2CC1CS2(=O)=O,304.07504,[M+H]+,20.0,val,O=C(c1ccc2nccnc2c1)N1CC2CC1CS2(=O)=O
453687,O=C(c1cc2nccnc2cc1)N1CC2CC1CS2(=O)=O,304.07504,[M+H]+,60.0,val,O=C(c1ccc2nccnc2c1)N1CC2CC1CS2(=O)=O
453688,O=C(c1cc2nccnc2cc1)N1CC2CC1CS2(=O)=O,304.07504,[M+H]+,30.0,val,O=C(c1ccc2nccnc2c1)N1CC2CC1CS2(=O)=O
453689,O=C(c1cc2nccnc2cc1)N1CC2CC1CS2(=O)=O,304.07504,[M+H]+,20.0,val,O=C(c1ccc2nccnc2c1)N1CC2CC1CS2(=O)=O
453690,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453691,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453692,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,60.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453693,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,30.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453694,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453695,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,30.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453696,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453697,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,302.06049,[M-H]-,60.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453698,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453699,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453700,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,45.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453701,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,60.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453702,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453703,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,45.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453704,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,60.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453705,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12,304.07504,[M+H]+,20.0,val,COc1ccccc1NS(=O)(=O)c1c[nH]c2ncccc12
453706,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C,304.07504,[M+H]+,20.0,val,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C
453707,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C,304.07504,[M+H]+,20.0,val,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C
453708,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C,304.07504,[M+H]+,60.0,val,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C
453709,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C,304.07504,[M+H]+,30.0,val,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C
453710,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C,304.07504,[M+H]+,20.0,val,Cc1nc(SCC2=NNC(=O)c3ccccc3O2)oc1C
453711,COc1c(OC)cc(/C=C/c2c([N+](=O)[O-])c(=O)[nH]c(=O)[nH]2)cc1,318.07316,[M-H]-,20.0,val,COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OC
453712,COc1c(OC)cc(/C=C/c2c([N+](=O)[O-])c(=O)[nH]c(=O)[nH]2)cc1,318.07316,[M-H]-,20.0,val,COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OC
453713,COc1c(OC)cc(/C=C/c2c([N+](=O)[O-])c(=O)[nH]c(=O)[nH]2)cc1,318.07316,[M-H]-,60.0,val,COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OC
453714,COc1c(OC)cc(/C=C/c2c([N+](=O)[O-])c(=O)[nH]c(=O)[nH]2)cc1,318.07316,[M-H]-,30.0,val,COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OC
453715,COc1c(OC)cc(/C=C/c2c([N+](=O)[O-])c(=O)[nH]c(=O)[nH]2)cc1,318.07316,[M-H]-,20.0,val,COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OC
453716,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,20.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453717,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,20.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453718,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,60.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453719,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,30.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453720,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,20.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453721,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,60.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453722,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,30.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453723,CC1c2c(CCN1c1ncc(C#N)cc1)scc2,256.09029,[M+H]+,20.0,val,CC1c2ccsc2CCN1c1ccc(C#N)cn1
453724,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453725,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453726,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,60.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453727,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,30.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453728,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453729,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,60.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453730,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,30.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453731,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,242.08227,[M-H]-,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453732,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453733,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453734,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,60.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453735,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,15.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453736,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453737,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,60.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453738,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,15.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453739,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,242.08227,[M-H]-,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453740,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453741,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453742,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,60.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453743,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453744,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,45.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453745,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,60.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453746,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453747,Cc1c(C)cc(-n2cc(C(=O)O)ccc2=O)cc1,244.09682,[M+H]+,45.0,val,Cc1ccc(-n2cc(C(=O)O)ccc2=O)cc1C
453748,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453749,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453750,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,60.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453751,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453752,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,45.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453753,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,60.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453754,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,20.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453755,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O,244.09682,[M+H]+,45.0,val,Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)O
453756,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,20.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453757,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,20.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453758,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,60.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453759,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,30.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453760,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,20.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453761,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,60.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453762,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,30.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453763,Cc1cc(Cn2cccc(C(=O)O)c2=O)ccc1,244.09682,[M+H]+,20.0,val,Cc1cccc(Cn2cccc(C(=O)O)c2=O)c1
453764,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,322.04225,[M-H]-,20.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453765,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,322.04225,[M-H]-,20.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453766,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,322.04225,[M-H]-,60.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453767,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,322.04225,[M-H]-,15.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453768,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,322.04225,[M-H]-,20.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453769,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,324.0568,[M+H]+,30.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453770,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,324.0568,[M+H]+,30.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453771,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,324.0568,[M+H]+,20.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453772,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,324.0568,[M+H]+,60.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453773,Cc1c(C)c(Nc2cc(Cl)nc(SCC(=O)O)n2)ccc1,324.0568,[M+H]+,30.0,val,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C
453774,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,322.04225,[M-H]-,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453775,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,322.04225,[M-H]-,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453776,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,322.04225,[M-H]-,60.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453777,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,322.04225,[M-H]-,30.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453778,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,322.04225,[M-H]-,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453779,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453780,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453781,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,60.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453782,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,30.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453783,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453784,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,324.0568,[M+H]+,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453785,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,324.0568,[M+H]+,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453786,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,324.0568,[M+H]+,60.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453787,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,324.0568,[M+H]+,30.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453788,CCC(=O)Nc1c2C[S+]([O-])Cc2nn1-c1cccc(Cl)c1,324.0568,[M+H]+,20.0,val,CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S+]([O-])C2
453789,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453790,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453791,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,60.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453792,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,15.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453793,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453794,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453795,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,15.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453796,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,322.04225,[M-H]-,60.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453797,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,358.01893,[M+Cl]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453798,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,358.01893,[M+Cl]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453799,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,358.01893,[M+Cl]-,60.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453800,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,358.01893,[M+Cl]-,15.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453801,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,358.01893,[M+Cl]-,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453802,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,322.04225,[M-H]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453803,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,322.04225,[M-H]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453804,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,322.04225,[M-H]-,60.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453805,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,322.04225,[M-H]-,15.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453806,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,322.04225,[M-H]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453807,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453808,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453809,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,60.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453810,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,15.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453811,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453812,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,15.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453813,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,20.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453814,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1,368.04773,[M+FA]-,60.0,val,CNC(=O)c1nc(C(=O)NCCc2ccc(Cl)cc2)cs1
453815,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453816,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453817,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,60.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453818,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,30.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453819,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453820,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,60.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453821,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,30.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453822,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1,324.0568,[M+H]+,20.0,val,Cc1csc(C(=O)N2CCC(Oc3ncc(Cl)cn3)C2)c1
453823,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1,324.0568,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1
453824,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1,324.0568,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1
453825,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1,324.0568,[M+H]+,60.0,val,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1
453826,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1,324.0568,[M+H]+,15.0,val,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1
453827,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1,324.0568,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCC(Oc2nccs2)C1
453828,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,324.0568,[M+H]+,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453829,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,324.0568,[M+H]+,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453830,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,324.0568,[M+H]+,60.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453831,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,324.0568,[M+H]+,15.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453832,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C,324.0568,[M+H]+,20.0,val,Cc1sc(NC(=O)Nc2ccc(Cl)cc2)c(C(N)=O)c1C
453833,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,20.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453834,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,20.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453835,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,60.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453836,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,15.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453837,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,20.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453838,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,60.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453839,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,20.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453840,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1,324.0568,[M+H]+,15.0,val,O=C(c1ccc(Cl)s1)N1CCCC(Oc2cnccn2)C1
453841,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1,292.06697,[M+H]+,20.0,val,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1
453842,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1,292.06697,[M+H]+,20.0,val,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1
453843,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1,292.06697,[M+H]+,60.0,val,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1
453844,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1,292.06697,[M+H]+,30.0,val,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1
453845,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1,292.06697,[M+H]+,20.0,val,Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1
453846,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453847,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453848,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453849,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453850,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453851,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453852,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453853,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,302.08141,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453854,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453855,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453856,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,304.09596,[M+H]+,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453857,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,304.09596,[M+H]+,30.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453858,CC(C)c1nc(NC(=O)c2cc3c(cccc3Cl)[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453859,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453860,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453861,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453862,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453863,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453864,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453865,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453866,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,302.08141,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453867,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,20.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453868,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,20.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453869,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,45.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453870,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,60.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453871,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,20.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453872,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,45.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453873,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,20.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453874,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21,304.09596,[M+H]+,60.0,val,CCn1cnc2c(Nc3cc(Cl)ccc3OC)ncnc21
453875,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453876,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453877,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453878,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,30.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453879,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453880,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,60.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453881,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,30.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453882,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1,304.09596,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)c2cc3c(Cl)cccc3[nH]2)n[nH]1
453883,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453884,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453885,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453886,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,30.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453887,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453888,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,30.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453889,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453890,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,323.07836,[M-H]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453891,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453892,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453893,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453894,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,15.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453895,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453896,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,15.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453897,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453898,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,359.05504,[M+Cl]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453899,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453900,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453901,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453902,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,15.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453903,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453904,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453905,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,15.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453906,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,369.08384,[M+FA]-,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453907,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453908,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453909,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,45.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453910,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453911,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453912,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,60.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453913,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,45.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453914,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1,325.09292,[M+H]+,20.0,val,O=C(NC1CN(c2ncnc3ccsc23)C1)C1CC(F)(F)C1
453915,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453916,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453917,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,60.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453918,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453919,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,60.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453920,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,340.10268,[M-H]-,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453921,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,342.11723,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453922,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,342.11723,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453923,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,342.11723,[M+H]+,60.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453924,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,342.11723,[M+H]+,30.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453925,CC(=O)N1CCN(C(=O)c2c3nc(C(F)(F)F)[nH]c3cnc2)CC1,342.11723,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)c2cncc3[nH]c(C(F)(F)F)nc23)CC1
453926,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,388.06967,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453927,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,388.06967,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453928,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,388.06967,[M-H]-,60.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453929,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,388.06967,[M-H]-,30.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453930,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,388.06967,[M-H]-,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453931,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,390.08422,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453932,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,390.08422,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453933,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,390.08422,[M+H]+,60.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453934,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,390.08422,[M+H]+,30.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453935,O=C(O)C1CCN(C(=O)CSc2nn3c(C(F)(F)F)nnc3cc2)CC1,390.08422,[M+H]+,20.0,val,O=C(O)C1CCN(C(=O)CSc2ccc3nnc(C(F)(F)F)n3n2)CC1
453936,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453937,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453938,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,60.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453939,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,30.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453940,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453941,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,60.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453942,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,30.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453943,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,300.0853,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453944,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,302.09985,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453945,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,302.09985,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453946,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,302.09985,[M+H]+,60.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453947,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,302.09985,[M+H]+,15.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453948,O=C(O)CC1(NC(=O)c2cc(C(F)(F)F)ccc2)CCC1,302.09985,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)c2cccc(C(F)(F)F)c2)CCC1
453949,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453950,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453951,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,60.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453952,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453953,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,45.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453954,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,60.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453955,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453956,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,45.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453957,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453958,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453959,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,45.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453960,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,60.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453961,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1,318.09477,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(OCC(F)(F)F)C2)cc1
453962,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1,271.10119,[M+H]+,20.0,val,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1
453963,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1,271.10119,[M+H]+,20.0,val,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1
453964,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1,271.10119,[M+H]+,60.0,val,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1
453965,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1,271.10119,[M+H]+,20.0,val,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1
453966,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1,271.10119,[M+H]+,45.0,val,CSc1ccc(CNc2cnc3[nH]ncc3c2)cc1
453967,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453968,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453969,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,60.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453970,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,30.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453971,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453972,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,60.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453973,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,30.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453974,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,281.11563,[M-H]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453975,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,327.12111,[M+FA]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453976,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,327.12111,[M+FA]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453977,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,327.12111,[M+FA]-,60.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453978,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,327.12111,[M+FA]-,15.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453979,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,327.12111,[M+FA]-,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453980,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453981,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453982,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453983,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,30.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453984,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453985,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453986,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,30.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453987,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,281.11563,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453988,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,327.12111,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453989,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,327.12111,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453990,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,327.12111,[M+FA]-,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453991,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,327.12111,[M+FA]-,15.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453992,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,327.12111,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453993,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,283.13018,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453994,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,283.13018,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453995,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,283.13018,[M+H]+,60.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453996,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,283.13018,[M+H]+,15.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453997,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1,283.13018,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)cn1
453998,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,283.13018,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
453999,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,283.13018,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
454000,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,283.13018,[M+H]+,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
454001,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,283.13018,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
454002,Cc1nc(-c2cc(NC(=O)c3cn(C)nc3)ccc2)n[nH]1,283.13018,[M+H]+,45.0,val,Cc1nc(-c2cccc(NC(=O)c3cnn(C)c3)c2)n[nH]1
454003,OCCNc1nc(Nc2ccccc2)nc2nccnc12,283.13018,[M+H]+,20.0,val,OCCNc1nc(Nc2ccccc2)nc2nccnc12
454004,OCCNc1nc(Nc2ccccc2)nc2nccnc12,283.13018,[M+H]+,20.0,val,OCCNc1nc(Nc2ccccc2)nc2nccnc12
454005,OCCNc1nc(Nc2ccccc2)nc2nccnc12,283.13018,[M+H]+,60.0,val,OCCNc1nc(Nc2ccccc2)nc2nccnc12
454006,OCCNc1nc(Nc2ccccc2)nc2nccnc12,283.13018,[M+H]+,20.0,val,OCCNc1nc(Nc2ccccc2)nc2nccnc12
454007,OCCNc1nc(Nc2ccccc2)nc2nccnc12,283.13018,[M+H]+,60.0,val,OCCNc1nc(Nc2ccccc2)nc2nccnc12
454008,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454009,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454010,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,45.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454011,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454012,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454013,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,45.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454014,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454015,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,310.05194,[M-H]-,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454016,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,346.02862,[M+Cl]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454017,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,346.02862,[M+Cl]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454018,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,346.02862,[M+Cl]-,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454019,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,346.02862,[M+Cl]-,15.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454020,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,346.02862,[M+Cl]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454021,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,356.05742,[M+FA]-,15.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454022,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,356.05742,[M+FA]-,15.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454023,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,356.05742,[M+FA]-,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454024,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,356.05742,[M+FA]-,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454025,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,356.05742,[M+FA]-,15.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454026,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454027,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454028,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,30.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454029,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454030,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,15.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454031,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454032,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,60.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454033,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1,312.06649,[M+H]+,20.0,val,Cc1cc(C)n(CCC(=O)Nc2cc(Cl)cc(Cl)c2)n1
454034,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,20.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454035,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,20.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454036,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,45.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454037,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,60.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454038,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,20.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454039,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,20.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454040,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,45.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454041,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C,312.06649,[M+H]+,60.0,val,CCn1nc(C)c(NC(=O)c2c(Cl)cccc2Cl)c1C
454042,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,45.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454043,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,45.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454044,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,45.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454045,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454046,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,60.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454047,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454048,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,45.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454049,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1,312.06649,[M+H]+,60.0,val,CCCc1cc(C(=O)Nc2cccc(Cl)c2Cl)n(C)n1
454050,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl,312.06649,[M+H]+,20.0,val,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl
454051,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl,312.06649,[M+H]+,20.0,val,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl
454052,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl,312.06649,[M+H]+,60.0,val,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl
454053,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl,312.06649,[M+H]+,30.0,val,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl
454054,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl,312.06649,[M+H]+,20.0,val,Cc1nn(CCNC(=O)c2ccccc2Cl)c(C)c1Cl
454055,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O,314.03562,[M-H]-,20.0,val,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O
454056,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O,314.03562,[M-H]-,20.0,val,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O
454057,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O,314.03562,[M-H]-,60.0,val,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O
454058,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O,314.03562,[M-H]-,30.0,val,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O
454059,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O,314.03562,[M-H]-,20.0,val,O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O
454060,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,20.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454061,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,20.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454062,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,45.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454063,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,60.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454064,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,20.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454065,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,20.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454066,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl,318.09794,[M+H]+,60.0,val,Cc1nc(N2CCC(C(F)(F)F)CC2)c(C#N)c(C)c1Cl
454067,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,363.06319,[M-H]-,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454068,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,363.06319,[M-H]-,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454069,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,363.06319,[M-H]-,60.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454070,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,363.06319,[M-H]-,30.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454071,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,363.06319,[M-H]-,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454072,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,347.06718,[M+H-H2O]+,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454073,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,347.06718,[M+H-H2O]+,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454074,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,347.06718,[M+H-H2O]+,60.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454075,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,347.06718,[M+H-H2O]+,15.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454076,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,347.06718,[M+H-H2O]+,20.0,val,Cn1cccc1C(O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
454077,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,323.12375,[M-H]-,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454078,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,323.12375,[M-H]-,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454079,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,323.12375,[M-H]-,60.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454080,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,323.12375,[M-H]-,30.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454081,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,323.12375,[M-H]-,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454082,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454083,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454084,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454085,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,30.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454086,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454087,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,30.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454088,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454089,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1,325.13831,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)c3nccc(C(F)(F)F)n3)C2)nn1
454090,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454091,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454092,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,45.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454093,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,60.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454094,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454095,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,60.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454096,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,45.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454097,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N2CCN(c3cnccn3)CC2)cc(C(F)(F)F)n1
454098,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454099,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454100,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,45.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454101,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,60.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454102,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454103,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,45.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454104,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,60.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454105,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1,325.13831,[M+H]+,20.0,val,Cc1nc(N(C)C2CN(c3cnccn3)C2)cc(C(F)(F)F)n1
454106,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454107,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454108,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,60.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454109,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,30.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454110,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454111,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,60.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454112,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,30.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454113,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,272.10406,[M-H]-,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454114,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454115,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454116,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,60.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454117,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,30.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454118,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454119,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,60.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454120,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,30.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454121,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,272.10406,[M-H]-,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454122,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,272.10406,[M-H]-,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454123,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,272.10406,[M-H]-,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454124,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,272.10406,[M-H]-,60.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454125,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,272.10406,[M-H]-,15.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454126,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,272.10406,[M-H]-,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454127,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,272.10406,[M-H]-,20.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454128,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,272.10406,[M-H]-,20.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454129,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,272.10406,[M-H]-,20.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454130,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,272.10406,[M-H]-,60.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454131,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,272.10406,[M-H]-,30.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454132,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,272.10406,[M-H]-,20.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454133,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,272.10406,[M-H]-,20.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454134,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,272.10406,[M-H]-,20.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454135,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,272.10406,[M-H]-,30.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454136,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,272.10406,[M-H]-,60.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454137,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454138,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454139,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,60.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454140,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454141,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,60.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454142,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,272.10406,[M-H]-,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454143,C[C@@H]1C(=O)N(c2cc3c(cc2)CCC(=O)N3)C(=O)N1C,274.11862,[M+H]+,20.0,val,C[C@@H]1C(=O)N(c2ccc3c(c2)NC(=O)CC3)C(=O)N1C
454144,C[C@@H]1C(=O)N(c2cc3c(cc2)CCC(=O)N3)C(=O)N1C,274.11862,[M+H]+,20.0,val,C[C@@H]1C(=O)N(c2ccc3c(c2)NC(=O)CC3)C(=O)N1C
454145,C[C@@H]1C(=O)N(c2cc3c(cc2)CCC(=O)N3)C(=O)N1C,274.11862,[M+H]+,60.0,val,C[C@@H]1C(=O)N(c2ccc3c(c2)NC(=O)CC3)C(=O)N1C
454146,C[C@@H]1C(=O)N(c2cc3c(cc2)CCC(=O)N3)C(=O)N1C,274.11862,[M+H]+,20.0,val,C[C@@H]1C(=O)N(c2ccc3c(c2)NC(=O)CC3)C(=O)N1C
454147,C[C@@H]1C(=O)N(c2cc3c(cc2)CCC(=O)N3)C(=O)N1C,274.11862,[M+H]+,45.0,val,C[C@@H]1C(=O)N(c2ccc3c(c2)NC(=O)CC3)C(=O)N1C
454148,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,274.11862,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454149,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,274.11862,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454150,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,274.11862,[M+H]+,60.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454151,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,274.11862,[M+H]+,30.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454152,O=C(O)C1CCCN1C(=O)Cc1c2ccccc2n[nH]1,274.11862,[M+H]+,20.0,val,O=C(O)C1CCCN1C(=O)Cc1[nH]nc2ccccc12
454153,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,274.11862,[M+H]+,20.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454154,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,274.11862,[M+H]+,20.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454155,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,274.11862,[M+H]+,60.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454156,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,274.11862,[M+H]+,30.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454157,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1,274.11862,[M+H]+,20.0,val,O=C(c1ccccc1)N1CCC(c2n[nH]c(=O)o2)CC1
454158,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,274.11862,[M+H]+,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454159,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,274.11862,[M+H]+,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454160,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,274.11862,[M+H]+,60.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454161,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,274.11862,[M+H]+,15.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454162,O=C(O)CCCCNC(=O)c1cc2nccnc2cc1,274.11862,[M+H]+,20.0,val,O=C(O)CCCCNC(=O)c1ccc2nccnc2c1
454163,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,274.11862,[M+H]+,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454164,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,274.11862,[M+H]+,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454165,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,274.11862,[M+H]+,60.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454166,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,274.11862,[M+H]+,30.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454167,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1,274.11862,[M+H]+,20.0,val,Cn1nccc1C(=O)NCC(C(=O)O)c1ccccc1
454168,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,274.11862,[M+H]+,20.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454169,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,274.11862,[M+H]+,20.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454170,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,274.11862,[M+H]+,60.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454171,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,274.11862,[M+H]+,15.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454172,COC(=O)c1c(NC(=O)[C@H](C)c2ccccc2)cn[nH]1,274.11862,[M+H]+,20.0,val,COC(=O)c1[nH]ncc1NC(=O)[C@H](C)c1ccccc1
454173,O=C1CCC(NC(=O)C2CCc3c2nccc3)C(=O)N1,274.11862,[M+H]+,20.0,val,O=C1CCC(NC(=O)C2CCc3cccnc32)C(=O)N1
454174,O=C1CCC(NC(=O)C2CCc3c2nccc3)C(=O)N1,274.11862,[M+H]+,20.0,val,O=C1CCC(NC(=O)C2CCc3cccnc32)C(=O)N1
454175,O=C1CCC(NC(=O)C2CCc3c2nccc3)C(=O)N1,274.11862,[M+H]+,60.0,val,O=C1CCC(NC(=O)C2CCc3cccnc32)C(=O)N1
454176,O=C1CCC(NC(=O)C2CCc3c2nccc3)C(=O)N1,274.11862,[M+H]+,30.0,val,O=C1CCC(NC(=O)C2CCc3cccnc32)C(=O)N1
454177,O=C1CCC(NC(=O)C2CCc3c2nccc3)C(=O)N1,274.11862,[M+H]+,20.0,val,O=C1CCC(NC(=O)C2CCc3cccnc32)C(=O)N1
454178,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,274.11862,[M+H]+,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454179,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,274.11862,[M+H]+,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454180,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,274.11862,[M+H]+,60.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454181,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,274.11862,[M+H]+,30.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454182,COC(=O)c1n[nH]c2c1cc(C(=O)N1CCCC1)cc2,274.11862,[M+H]+,20.0,val,COC(=O)c1n[nH]c2ccc(C(=O)N3CCCC3)cc12
454183,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,274.11862,[M+H]+,30.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454184,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,274.11862,[M+H]+,30.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454185,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,274.11862,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454186,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,274.11862,[M+H]+,60.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454187,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21,274.11862,[M+H]+,30.0,val,Cn1nc(C(=O)N2CCC(C(=O)O)C2)c2ccccc21
454188,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,318.10954,[M+FA]-,60.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454189,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,318.10954,[M+FA]-,15.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454190,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,318.10954,[M+FA]-,20.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454191,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,274.11862,[M+H]+,20.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454192,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,274.11862,[M+H]+,20.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454193,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,274.11862,[M+H]+,60.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454194,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,274.11862,[M+H]+,30.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454195,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O,274.11862,[M+H]+,20.0,val,CN1C(=O)CCC(N2Cc3c(N)cccc3C2=O)C1=O
454196,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454197,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454198,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454199,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454200,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454201,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454202,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454203,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454204,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454205,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454206,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454207,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454208,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454209,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454210,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454211,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,304.05838,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454212,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,304.05838,[M-H]-,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454213,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,304.05838,[M-H]-,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454214,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,304.05838,[M-H]-,60.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454215,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,304.05838,[M-H]-,30.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454216,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,304.05838,[M-H]-,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454217,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454218,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454219,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,60.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454220,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,30.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454221,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454222,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,60.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454223,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,30.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454224,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C,306.07293,[M+H]+,20.0,val,COc1c(C)cnc(CSc2nc3sccc3[nH]2)c1C
454225,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454226,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454227,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454228,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454229,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454230,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454231,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,30.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454232,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1,306.07293,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CC2c2ccccc2)s1
454233,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454234,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454235,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,60.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454236,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454237,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,45.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454238,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,60.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454239,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454240,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,284.1153,[M-H]-,45.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454241,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,20.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454242,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,20.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454243,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,60.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454244,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,30.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454245,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,20.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454246,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,60.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454247,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,30.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454248,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,286.12985,[M+H]+,20.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454249,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,308.11179,[M+Na]+,30.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454250,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,308.11179,[M+Na]+,30.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454251,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,308.11179,[M+Na]+,60.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454252,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,308.11179,[M+Na]+,20.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454253,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1,308.11179,[M+Na]+,30.0,val,COCC1(Cc2nc(-c3cccn4ncnc34)no2)CC1
454254,CCn1ncc2c1c(=O)n(Cc1cc(=O)n(C)cc1)cn2,286.12985,[M+H]+,20.0,val,CCn1ncc2ncn(Cc3ccn(C)c(=O)c3)c(=O)c21
454255,CCn1ncc2c1c(=O)n(Cc1cc(=O)n(C)cc1)cn2,286.12985,[M+H]+,20.0,val,CCn1ncc2ncn(Cc3ccn(C)c(=O)c3)c(=O)c21
454256,CCn1ncc2c1c(=O)n(Cc1cc(=O)n(C)cc1)cn2,286.12985,[M+H]+,60.0,val,CCn1ncc2ncn(Cc3ccn(C)c(=O)c3)c(=O)c21
454257,CCn1ncc2c1c(=O)n(Cc1cc(=O)n(C)cc1)cn2,286.12985,[M+H]+,20.0,val,CCn1ncc2ncn(Cc3ccn(C)c(=O)c3)c(=O)c21
454258,CCn1ncc2c1c(=O)n(Cc1cc(=O)n(C)cc1)cn2,286.12985,[M+H]+,45.0,val,CCn1ncc2ncn(Cc3ccn(C)c(=O)c3)c(=O)c21
454259,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454260,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454261,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,60.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454262,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,15.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454263,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454264,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,45.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454265,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,60.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454266,O=C1CN(C(=O)c2c(-c3ccncc3)[nH]nc2)CCCN1,286.12985,[M+H]+,20.0,val,O=C1CN(C(=O)c2cn[nH]c2-c2ccncc2)CCCN1
454267,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,20.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454268,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,20.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454269,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,60.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454270,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,20.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454271,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,60.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454272,c1csc(C2CCN(c3c4cc[nH]c4ncn3)CC2)n1,286.11209,[M+H]+,20.0,val,c1csc(C2CCN(c3ncnc4[nH]ccc34)CC2)n1
454273,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1,286.11209,[M+H]+,20.0,val,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1
454274,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1,286.11209,[M+H]+,20.0,val,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1
454275,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1,286.11209,[M+H]+,60.0,val,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1
454276,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1,286.11209,[M+H]+,15.0,val,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1
454277,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1,286.11209,[M+H]+,20.0,val,CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1
454278,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,20.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454279,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,20.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454280,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,45.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454281,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,60.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454282,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,20.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454283,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,45.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454284,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,60.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454285,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1,318.08416,[M+H]+,20.0,val,Cc1nnc(N2CCN(c3nsc4ccccc34)CC2)s1
454286,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,20.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454287,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,20.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454288,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,60.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454289,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,30.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454290,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,20.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454291,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,60.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454292,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,30.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454293,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1,334.06618,[M+H]+,20.0,val,Brc1cnn(C2CC3CCC(C2)N3c2ncccn2)c1
454294,COc1cc(CNCc2ccco2)cc(Br)c1OC,326.03863,[M+H]+,20.0,val,COc1cc(CNCc2ccco2)cc(Br)c1OC
454295,COc1cc(CNCc2ccco2)cc(Br)c1OC,326.03863,[M+H]+,20.0,val,COc1cc(CNCc2ccco2)cc(Br)c1OC
454296,COc1cc(CNCc2ccco2)cc(Br)c1OC,326.03863,[M+H]+,60.0,val,COc1cc(CNCc2ccco2)cc(Br)c1OC
454297,COc1cc(CNCc2ccco2)cc(Br)c1OC,326.03863,[M+H]+,15.0,val,COc1cc(CNCc2ccco2)cc(Br)c1OC
454298,COc1cc(CNCc2ccco2)cc(Br)c1OC,326.03863,[M+H]+,20.0,val,COc1cc(CNCc2ccco2)cc(Br)c1OC
454299,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1,358.0107,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1
454300,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1,358.0107,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1
454301,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1,358.0107,[M+H]+,60.0,val,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1
454302,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1,358.0107,[M+H]+,30.0,val,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1
454303,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1,358.0107,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2cccc(Br)c2)C1
454304,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1,322.10653,[M+H]+,20.0,val,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1
454305,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1,322.10653,[M+H]+,20.0,val,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1
454306,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1,322.10653,[M+H]+,60.0,val,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1
454307,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1,322.10653,[M+H]+,15.0,val,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1
454308,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1,322.10653,[M+H]+,20.0,val,COC1(C)CN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1
454309,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454310,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454311,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,45.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454312,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454313,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454314,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,45.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454315,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454316,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1,322.10653,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccccc2Cl)nc(N(C)C)n1
454317,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1,322.10653,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1
454318,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1,322.10653,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1
454319,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1,322.10653,[M+H]+,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1
454320,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1,322.10653,[M+H]+,30.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1
454321,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1,322.10653,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccno2)CC1
454322,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1,322.10653,[M+H]+,20.0,val,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1
454323,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1,322.10653,[M+H]+,20.0,val,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1
454324,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1,322.10653,[M+H]+,60.0,val,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1
454325,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1,322.10653,[M+H]+,15.0,val,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1
454326,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1,322.10653,[M+H]+,20.0,val,COc1cnc(OC2CCN(c3ncc(Cl)cn3)CC2)nc1
454327,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,20.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454328,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,20.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454329,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,45.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454330,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,60.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454331,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,20.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454332,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,20.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454333,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,60.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454334,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1,318.12285,[M+H]+,45.0,val,Cc1nc(N2CC(Cn3cc(Cl)cn3)C2)c2cnn(C)c2n1
454335,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,368.07989,[M+Cl]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454336,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,368.07989,[M+Cl]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454337,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,368.07989,[M+Cl]-,60.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454338,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,368.07989,[M+Cl]-,30.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454339,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,368.07989,[M+Cl]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454340,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454341,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454342,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,60.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454343,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,15.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454344,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454345,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,60.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454346,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454347,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,378.10869,[M+FA]-,15.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454348,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454349,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454350,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,60.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454351,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,30.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454352,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454353,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,30.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454354,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,20.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454355,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21,334.11776,[M+H]+,60.0,val,O=C(CCCn1cnnn1)NCCn1cnc2cc(Cl)ccc21
454356,COc1cc2c(cc1)[nH]cc2C1=CCNCC1,229.13354,[M+H]+,20.0,val,COc1ccc2[nH]cc(C3=CCNCC3)c2c1
454357,COc1cc2c(cc1)[nH]cc2C1=CCNCC1,229.13354,[M+H]+,20.0,val,COc1ccc2[nH]cc(C3=CCNCC3)c2c1
454358,COc1cc2c(cc1)[nH]cc2C1=CCNCC1,229.13354,[M+H]+,60.0,val,COc1ccc2[nH]cc(C3=CCNCC3)c2c1
454359,COc1cc2c(cc1)[nH]cc2C1=CCNCC1,229.13354,[M+H]+,15.0,val,COc1ccc2[nH]cc(C3=CCNCC3)c2c1
454360,COc1cc2c(cc1)[nH]cc2C1=CCNCC1,229.13354,[M+H]+,20.0,val,COc1ccc2[nH]cc(C3=CCNCC3)c2c1
454361,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454362,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454363,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,60.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454364,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,15.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454365,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454366,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,15.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454367,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,60.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454368,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,353.09904,[M+FA]-,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454369,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454370,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454371,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,60.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454372,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454373,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,20.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454374,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O,309.10811,[M+H]+,60.0,val,COc1c2n(cc(C(=O)O)c1=O)C[C@@H]1OCC[C@@H](C)N1C2=O
454375,Cc1nc2c(C(=O)NCc3c(C)n(C)nc3)cnn2cc1,285.14583,[M+H]+,20.0,val,Cc1ccn2ncc(C(=O)NCc3cnn(C)c3C)c2n1
454376,Cc1nc2c(C(=O)NCc3c(C)n(C)nc3)cnn2cc1,285.14583,[M+H]+,20.0,val,Cc1ccn2ncc(C(=O)NCc3cnn(C)c3C)c2n1
454377,Cc1nc2c(C(=O)NCc3c(C)n(C)nc3)cnn2cc1,285.14583,[M+H]+,60.0,val,Cc1ccn2ncc(C(=O)NCc3cnn(C)c3C)c2n1
454378,Cc1nc2c(C(=O)NCc3c(C)n(C)nc3)cnn2cc1,285.14583,[M+H]+,15.0,val,Cc1ccn2ncc(C(=O)NCc3cnn(C)c3C)c2n1
454379,Cc1nc2c(C(=O)NCc3c(C)n(C)nc3)cnn2cc1,285.14583,[M+H]+,20.0,val,Cc1ccn2ncc(C(=O)NCc3cnn(C)c3C)c2n1
454380,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,20.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454381,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,20.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454382,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,60.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454383,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,15.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454384,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,20.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454385,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,45.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454386,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,60.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454387,Cc1noc(C2CCCN(c3c4cc[nH]c4ncn3)C2)n1,285.14583,[M+H]+,20.0,val,Cc1noc(C2CCCN(c3ncnc4[nH]ccc34)C2)n1
454388,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,285.14583,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454389,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,285.14583,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454390,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,285.14583,[M+H]+,60.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454391,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,285.14583,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454392,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,285.14583,[M+H]+,45.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454393,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,302.17238,[M+NH4]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454394,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,302.17238,[M+NH4]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454395,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,302.17238,[M+NH4]+,60.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454396,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,302.17238,[M+NH4]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454397,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21,302.17238,[M+NH4]+,60.0,val,Cn1ncc2c(Nc3ccccc3)nc(NCCO)nc21
454398,OCCN(CCc1nc2c(ccc(Br)c2)o1)C1CC1,325.05462,[M+H]+,20.0,val,OCCN(CCc1nc2cc(Br)ccc2o1)C1CC1
454399,OCCN(CCc1nc2c(ccc(Br)c2)o1)C1CC1,325.05462,[M+H]+,20.0,val,OCCN(CCc1nc2cc(Br)ccc2o1)C1CC1
454400,OCCN(CCc1nc2c(ccc(Br)c2)o1)C1CC1,325.05462,[M+H]+,60.0,val,OCCN(CCc1nc2cc(Br)ccc2o1)C1CC1
454401,OCCN(CCc1nc2c(ccc(Br)c2)o1)C1CC1,325.05462,[M+H]+,15.0,val,OCCN(CCc1nc2cc(Br)ccc2o1)C1CC1
454402,OCCN(CCc1nc2c(ccc(Br)c2)o1)C1CC1,325.05462,[M+H]+,20.0,val,OCCN(CCc1nc2cc(Br)ccc2o1)C1CC1
454403,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1,325.05462,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1
454404,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1,325.05462,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1
454405,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1,325.05462,[M+H]+,20.0,val,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1
454406,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1,325.05462,[M+H]+,60.0,val,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1
454407,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1,325.05462,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(Oc2ccc(Br)cn2)C1
454408,CCNC(=O)N1CCN(C(=O)c2c(F)ccc(Cl)c2)CC1,314.10661,[M+H]+,20.0,val,CCNC(=O)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1
454409,CCNC(=O)N1CCN(C(=O)c2c(F)ccc(Cl)c2)CC1,314.10661,[M+H]+,20.0,val,CCNC(=O)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1
454410,CCNC(=O)N1CCN(C(=O)c2c(F)ccc(Cl)c2)CC1,314.10661,[M+H]+,60.0,val,CCNC(=O)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1
454411,CCNC(=O)N1CCN(C(=O)c2c(F)ccc(Cl)c2)CC1,314.10661,[M+H]+,15.0,val,CCNC(=O)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1
454412,CCNC(=O)N1CCN(C(=O)c2c(F)ccc(Cl)c2)CC1,314.10661,[M+H]+,20.0,val,CCNC(=O)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1
454413,Cc1c(Cl)c(NC(=O)c2cccn(CC(C)C)c2=O)n[nH]1,309.11128,[M+H]+,20.0,val,Cc1[nH]nc(NC(=O)c2cccn(CC(C)C)c2=O)c1Cl
454414,Cc1c(Cl)c(NC(=O)c2cccn(CC(C)C)c2=O)n[nH]1,309.11128,[M+H]+,20.0,val,Cc1[nH]nc(NC(=O)c2cccn(CC(C)C)c2=O)c1Cl
454415,Cc1c(Cl)c(NC(=O)c2cccn(CC(C)C)c2=O)n[nH]1,309.11128,[M+H]+,60.0,val,Cc1[nH]nc(NC(=O)c2cccn(CC(C)C)c2=O)c1Cl
454416,Cc1c(Cl)c(NC(=O)c2cccn(CC(C)C)c2=O)n[nH]1,309.11128,[M+H]+,15.0,val,Cc1[nH]nc(NC(=O)c2cccn(CC(C)C)c2=O)c1Cl
454417,Cc1c(Cl)c(NC(=O)c2cccn(CC(C)C)c2=O)n[nH]1,309.11128,[M+H]+,20.0,val,Cc1[nH]nc(NC(=O)c2cccn(CC(C)C)c2=O)c1Cl
454418,CCCNC(=O)c1c(C)n(-c2cc(Cl)c(OC)cc2)nn1,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454419,CCCNC(=O)c1c(C)n(-c2cc(Cl)c(OC)cc2)nn1,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454420,CCCNC(=O)c1c(C)n(-c2cc(Cl)c(OC)cc2)nn1,309.11128,[M+H]+,60.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454421,CCCNC(=O)c1c(C)n(-c2cc(Cl)c(OC)cc2)nn1,309.11128,[M+H]+,30.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454422,CCCNC(=O)c1c(C)n(-c2cc(Cl)c(OC)cc2)nn1,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454423,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454424,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454425,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,60.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454426,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,30.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454427,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454428,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454429,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454430,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C,309.11128,[M+H]+,60.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454431,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C,309.11128,[M+H]+,15.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454432,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C,309.11128,[M+H]+,20.0,val,CCCNC(=O)c1nnn(-c2ccc(OC)c(Cl)c2)c1C
454433,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454434,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454435,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,30.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454436,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,60.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454437,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,15.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454438,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454439,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,20.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454440,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C,309.11128,[M+H]+,60.0,val,Cc1noc(C)c1C1CCCN1C(=O)c1c(Cl)cnn1C
454441,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,20.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454442,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,20.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454443,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,60.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454444,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,30.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454445,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,20.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454446,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,60.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454447,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,20.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454448,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl,309.11128,[M+H]+,30.0,val,CCOc1ncccc1CNC(=O)c1nn(CC)cc1Cl
454449,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,20.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454450,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,20.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454451,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,60.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454452,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,30.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454453,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,20.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454454,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,60.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454455,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,30.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454456,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1,309.11128,[M+H]+,20.0,val,CCc1cc(C2CCCN2C(=O)c2c(Cl)cnn2C)on1
454457,Clc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454458,Clc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454459,Clc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,325.08844,[M+H]+,60.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454460,Clc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,325.08844,[M+H]+,30.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454461,Clc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454462,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1,325.08844,[M+H]+,20.0,val,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1
454463,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1,325.08844,[M+H]+,20.0,val,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1
454464,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1,325.08844,[M+H]+,60.0,val,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1
454465,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1,325.08844,[M+H]+,15.0,val,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1
454466,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1,325.08844,[M+H]+,20.0,val,Cc1nsc(N2CCC(COc3ccncc3Cl)CC2)n1
454467,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454468,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454469,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,15.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454470,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,60.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454471,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454472,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,45.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454473,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,20.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454474,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1,325.08844,[M+H]+,60.0,val,Clc1cnc(NCC(c2ccsc2)N2CCOCC2)nc1
454475,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454476,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454477,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454478,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,15.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454479,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454480,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454481,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,15.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454482,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,365.06108,[M-H]-,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454483,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,401.03776,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454484,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,401.03776,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454485,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,401.03776,[M+Cl]-,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454486,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,401.03776,[M+Cl]-,30.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454487,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,401.03776,[M+Cl]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454488,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454489,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454490,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454491,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,15.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454492,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454493,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454494,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,15.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454495,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,411.06656,[M+FA]-,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454496,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,349.06507,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454497,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,349.06507,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454498,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,349.06507,[M+H-H2O]+,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454499,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,349.06507,[M+H-H2O]+,30.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454500,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,349.06507,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454501,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,367.07563,[M+H]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454502,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,367.07563,[M+H]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454503,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,367.07563,[M+H]+,60.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454504,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,367.07563,[M+H]+,15.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454505,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1,367.07563,[M+H]+,20.0,val,O=C(NCC1(O)CSCCSC1)Nc1ccc(C(F)(F)F)cc1
454506,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454507,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454508,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,60.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454509,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454510,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,45.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454511,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,60.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454512,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454513,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,329.12308,[M-H]-,45.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454514,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454515,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454516,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,60.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454517,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,30.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454518,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454519,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,60.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454520,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,30.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454521,CC(C)C1C(=O)NCCN1C(=O)Nc1cnc(C(F)(F)F)cc1,331.13764,[M+H]+,20.0,val,CC(C)C1C(=O)NCCN1C(=O)Nc1ccc(C(F)(F)F)nc1
454522,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,20.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454523,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,20.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454524,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,45.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454525,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,60.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454526,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,20.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454527,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,60.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454528,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1,331.13764,[M+H]+,20.0,val,Cc1nc(N2CCOC(C(=O)NC3CC3)C2)cc(C(F)(F)F)n1
454529,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454530,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454531,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,60.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454532,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454533,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,45.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454534,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,60.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454535,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454536,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,327.08203,[M-H]-,45.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454537,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,329.09658,[M+H]+,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454538,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,329.09658,[M+H]+,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454539,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,329.09658,[M+H]+,60.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454540,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,329.09658,[M+H]+,30.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454541,CS(=O)(=O)Nc1c(F)ccc(C(=O)N2CCOCC23CC3)c1,329.09658,[M+H]+,20.0,val,CS(=O)(=O)Nc1cc(C(=O)N2CCOCC23CC3)ccc1F
454542,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,20.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454543,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,20.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454544,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,60.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454545,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,20.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454546,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,45.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454547,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,60.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454548,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,20.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454549,c1nc(NC2CCC2)c2c3c(CCCC3)sc2n1,260.1216,[M+H]+,45.0,val,c1nc(NC2CCC2)c2c3c(sc2n1)CCCC3
454550,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,318.12078,[M-H]-,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454551,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,318.12078,[M-H]-,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454552,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,318.12078,[M-H]-,60.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454553,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,318.12078,[M-H]-,15.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454554,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,318.12078,[M-H]-,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454555,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,320.13533,[M+H]+,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454556,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,320.13533,[M+H]+,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454557,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,320.13533,[M+H]+,60.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454558,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,320.13533,[M+H]+,15.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454559,NC(=O)NC(=O)c1cc(NC(=O)CN2CCCNC2=O)ccc1,320.13533,[M+H]+,20.0,val,NC(=O)NC(=O)c1cccc(NC(=O)CN2CCCNC2=O)c1
454560,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454561,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454562,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454563,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,15.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454564,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454565,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,45.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454566,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454567,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1,320.13533,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccoc2)nc(N2CCOCC2)n1
454568,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,20.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454569,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,20.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454570,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,60.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454571,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,20.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454572,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,45.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454573,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,60.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454574,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,20.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454575,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1,304.12266,[M+H]+,45.0,val,CC(C)c1nn(C)cc1-c1noc(CCc2cscn2)n1
454576,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1,304.12266,[M+H]+,20.0,val,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1
454577,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1,304.12266,[M+H]+,20.0,val,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1
454578,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1,304.12266,[M+H]+,60.0,val,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1
454579,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1,304.12266,[M+H]+,15.0,val,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1
454580,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1,304.12266,[M+H]+,20.0,val,Cc1nccc(NC(=O)N2CCC(c3nccs3)CC2)n1
454581,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,286.1121,[M+H-H2O]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454582,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,286.1121,[M+H-H2O]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454583,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,286.1121,[M+H-H2O]+,60.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454584,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,286.1121,[M+H-H2O]+,15.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454585,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,286.1121,[M+H-H2O]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454586,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,304.12266,[M+H]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454587,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,304.12266,[M+H]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454588,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,304.12266,[M+H]+,60.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454589,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,304.12266,[M+H]+,15.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454590,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1,304.12266,[M+H]+,20.0,val,Cn1cc(Cn2cc(CC(C)(O)c3cccs3)nn2)cn1
454591,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,302.10811,[M-H]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454592,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,302.10811,[M-H]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454593,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,302.10811,[M-H]-,60.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454594,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,302.10811,[M-H]-,30.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454595,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,302.10811,[M-H]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454596,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,348.11358,[M+FA]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454597,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,348.11358,[M+FA]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454598,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,348.11358,[M+FA]-,60.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454599,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,348.11358,[M+FA]-,15.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454600,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,348.11358,[M+FA]-,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454601,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454602,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454603,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,15.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454604,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,60.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454605,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,30.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454606,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454607,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,60.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454608,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,302.10811,[M-H]-,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454609,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454610,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454611,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,60.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454612,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,30.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454613,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454614,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454615,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,30.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454616,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,302.10811,[M-H]-,60.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454617,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,20.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454618,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,20.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454619,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,60.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454620,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,30.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454621,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,20.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454622,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,60.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454623,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,30.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454624,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1,304.12266,[M+H]+,20.0,val,O=C(CN1CCN(c2ccccn2)CC1)Nc1nccs1
454625,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,20.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454626,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,20.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454627,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,45.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454628,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,60.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454629,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,20.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454630,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,45.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454631,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,60.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454632,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1,304.12266,[M+H]+,20.0,val,Cn1cnc(C(=O)N2CC3CN(c4nccs4)CC3C2)c1
454633,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454634,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454635,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,60.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454636,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,15.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454637,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454638,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,60.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454639,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,15.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454640,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1,304.12266,[M+H]+,20.0,val,CC(NC(=O)CSc1nc(N)cc(N)n1)c1ccccc1
454641,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,286.1121,[M+H-H2O]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454642,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,286.1121,[M+H-H2O]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454643,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,286.1121,[M+H-H2O]+,60.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454644,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,286.1121,[M+H-H2O]+,15.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454645,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,286.1121,[M+H-H2O]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454646,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,304.12266,[M+H]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454647,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,304.12266,[M+H]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454648,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,304.12266,[M+H]+,60.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454649,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,304.12266,[M+H]+,15.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454650,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1,304.12266,[M+H]+,20.0,val,Cc1cnn(CCC(=O)NNC(=S)Nc2ccccc2)c1
454651,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,20.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454652,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,20.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454653,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,45.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454654,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,60.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454655,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,20.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454656,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,45.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454657,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,60.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454658,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12,304.12266,[M+H]+,20.0,val,Cc1csc2c(N3CC(N4CCNC(=O)C4)C3)ncnc12
454659,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,20.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454660,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,20.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454661,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,30.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454662,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,60.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454663,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,15.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454664,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,20.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454665,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,60.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454666,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12,304.12266,[M+H]+,20.0,val,COCCc1nnc2sc(-c3ccc(N(C)C)cc3)nn12
454667,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,304.12266,[M+H]+,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454668,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,304.12266,[M+H]+,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454669,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,304.12266,[M+H]+,60.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454670,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,304.12266,[M+H]+,15.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454671,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1,304.12266,[M+H]+,20.0,val,Cc1ccn(CC(=O)NNC(=S)NCc2ccccc2)n1
454672,CC(C)c1nc2c(cc(NCc3cnnn3C)cc2)s1,288.12774,[M+H]+,20.0,val,CC(C)c1nc2ccc(NCc3cnnn3C)cc2s1
454673,CC(C)c1nc2c(cc(NCc3cnnn3C)cc2)s1,288.12774,[M+H]+,20.0,val,CC(C)c1nc2ccc(NCc3cnnn3C)cc2s1
454674,CC(C)c1nc2c(cc(NCc3cnnn3C)cc2)s1,288.12774,[M+H]+,60.0,val,CC(C)c1nc2ccc(NCc3cnnn3C)cc2s1
454675,CC(C)c1nc2c(cc(NCc3cnnn3C)cc2)s1,288.12774,[M+H]+,30.0,val,CC(C)c1nc2ccc(NCc3cnnn3C)cc2s1
454676,CC(C)c1nc2c(cc(NCc3cnnn3C)cc2)s1,288.12774,[M+H]+,20.0,val,CC(C)c1nc2ccc(NCc3cnnn3C)cc2s1
454677,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,343.04629,[M-H]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454678,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,343.04629,[M-H]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454679,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,343.04629,[M-H]-,60.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454680,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,343.04629,[M-H]-,30.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454681,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,343.04629,[M-H]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454682,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,389.05177,[M+FA]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454683,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,389.05177,[M+FA]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454684,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,389.05177,[M+FA]-,60.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454685,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,389.05177,[M+FA]-,15.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454686,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,389.05177,[M+FA]-,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454687,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,345.06084,[M+H]+,15.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454688,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,345.06084,[M+H]+,15.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454689,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,345.06084,[M+H]+,60.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454690,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,345.06084,[M+H]+,20.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454691,Cc1c(C(=O)N(CC(N)=O)CC(C)C)cc(F)cc1Br,345.06084,[M+H]+,15.0,val,Cc1c(Br)cc(F)cc1C(=O)N(CC(N)=O)CC(C)C
454692,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,400.05136,[M+FA]-,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454693,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,400.05136,[M+FA]-,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454694,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,400.05136,[M+FA]-,60.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454695,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,400.05136,[M+FA]-,15.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454696,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,400.05136,[M+FA]-,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454697,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,356.06043,[M+H]+,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454698,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,356.06043,[M+H]+,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454699,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,356.06043,[M+H]+,60.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454700,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,356.06043,[M+H]+,15.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454701,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1,356.06043,[M+H]+,20.0,val,C[C@@H](NC(=O)N1CCOC(C(N)=O)C1)c1ccc(Br)cc1
454702,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,306.11271,[M-H]-,20.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454703,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,306.11271,[M-H]-,20.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454704,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,306.11271,[M-H]-,60.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454705,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,306.11271,[M-H]-,30.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454706,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,306.11271,[M-H]-,20.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454707,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,308.12726,[M+H]+,15.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454708,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,308.12726,[M+H]+,15.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454709,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,308.12726,[M+H]+,20.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454710,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,308.12726,[M+H]+,60.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454711,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1n[nH]nn1,308.12726,[M+H]+,15.0,val,CC(Cc1ccccc1Cl)C(=O)NC(C)(C)c1nn[nH]n1
454712,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,278.13103,[M-H]-,20.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454713,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,278.13103,[M-H]-,20.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454714,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,278.13103,[M-H]-,60.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454715,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,278.13103,[M-H]-,30.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454716,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,278.13103,[M-H]-,20.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454717,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,280.14558,[M+H]+,15.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454718,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,280.14558,[M+H]+,15.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454719,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,280.14558,[M+H]+,20.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454720,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,280.14558,[M+H]+,60.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454721,CCC1C(=O)NCCN1CC(=O)Nc1cc(F)ccc1,280.14558,[M+H]+,15.0,val,CCC1C(=O)NCCN1CC(=O)Nc1cccc(F)c1
454722,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,20.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454723,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,20.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454724,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,45.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454725,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,60.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454726,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,20.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454727,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,60.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454728,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,45.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454729,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1,343.06032,[M+H]+,20.0,val,Cc1nc(-c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)cs1
454730,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,20.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454731,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,20.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454732,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,60.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454733,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,20.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454734,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,60.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454735,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1,343.06032,[M+H]+,20.0,val,Cc1csc(-c2csc(S(=O)(=O)N3CCCCCC3)c2)n1
454736,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454737,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454738,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,45.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454739,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,60.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454740,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454741,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,45.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454742,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454743,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,341.06352,[M-H]-,60.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454744,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,377.0402,[M+Cl]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454745,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,377.0402,[M+Cl]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454746,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,377.0402,[M+Cl]-,60.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454747,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,377.0402,[M+Cl]-,15.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454748,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1,377.0402,[M+Cl]-,20.0,val,Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1
454749,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,20.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454750,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,20.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454751,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,60.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454752,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,30.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454753,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,20.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454754,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,60.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454755,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,30.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454756,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,309.10921,[M-H]-,20.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454757,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,345.08589,[M+Cl]-,15.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454758,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,345.08589,[M+Cl]-,15.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454759,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,345.08589,[M+Cl]-,20.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454760,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,345.08589,[M+Cl]-,60.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454761,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1,345.08589,[M+Cl]-,15.0,val,CC(C)(CCC(=O)O)NC(=O)COc1ccc([N+](=O)[O-])cc1
454762,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,337.0976,[M-H]-,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454763,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,337.0976,[M-H]-,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454764,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,337.0976,[M-H]-,60.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454765,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,337.0976,[M-H]-,30.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454766,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,337.0976,[M-H]-,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454767,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454768,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454769,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,60.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454770,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,30.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454771,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454772,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,60.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454773,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,30.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454774,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,337.0976,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454775,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454776,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454777,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,60.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454778,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,30.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454779,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454780,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,60.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454781,Cc1c(S(=O)(=O)NCC(Cc2ccccn2)C(=O)O)n(C)nc1,339.11215,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)NCC(Cc1ccccn1)C(=O)O
454782,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454783,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454784,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,60.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454785,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,30.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454786,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454787,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,60.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454788,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,30.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454789,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1,339.11215,[M+H]+,20.0,val,Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)c(=O)[nH]1
454790,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,20.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454791,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,20.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454792,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,60.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454793,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,30.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454794,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,20.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454795,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,30.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454796,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,60.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454797,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1,339.11215,[M+H]+,20.0,val,Cn1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)cn1
454798,Cn1ncc2c1nnn(CC(=O)N1CCOCC1C1CC1)c2=O,319.15131,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCOCC3C3CC3)nnc21
454799,Cn1ncc2c1nnn(CC(=O)N1CCOCC1C1CC1)c2=O,319.15131,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCOCC3C3CC3)nnc21
454800,Cn1ncc2c1nnn(CC(=O)N1CCOCC1C1CC1)c2=O,319.15131,[M+H]+,60.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCOCC3C3CC3)nnc21
454801,Cn1ncc2c1nnn(CC(=O)N1CCOCC1C1CC1)c2=O,319.15131,[M+H]+,15.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCOCC3C3CC3)nnc21
454802,Cn1ncc2c1nnn(CC(=O)N1CCOCC1C1CC1)c2=O,319.15131,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCOCC3C3CC3)nnc21
454803,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,20.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454804,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,20.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454805,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,60.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454806,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,30.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454807,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,20.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454808,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,45.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454809,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,60.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454810,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1,319.13356,[M+H]+,20.0,val,COCc1nsc(N2CC3CN(c4cnccn4)CC3C2)n1
454811,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,392.05144,[M+FA]-,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454812,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,392.05144,[M+FA]-,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454813,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,392.05144,[M+FA]-,60.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454814,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,392.05144,[M+FA]-,15.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454815,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,392.05144,[M+FA]-,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454816,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,20.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454817,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,20.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454818,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,60.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454819,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,30.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454820,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,20.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454821,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,60.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454822,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,30.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454823,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO,348.06051,[M+H]+,20.0,val,Cc1c(Br)ccc(F)c1C(=O)N(C)CC(C)(CO)CO
454824,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,348.06051,[M+H]+,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454825,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,348.06051,[M+H]+,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454826,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,348.06051,[M+H]+,60.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454827,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1c(F)cc(Br)cc1,348.06051,[M+H]+,20.0,val,CC(O)(CN1C[C@H](O)C[C@H]1CO)c1ccc(Br)cc1F
454828,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cc(Br)cnc1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454829,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cc(Br)cnc1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454830,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cc(Br)cnc1,327.07027,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454831,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cc(Br)cnc1,327.07027,[M+H]+,30.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454832,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cc(Br)cnc1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454833,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1,327.07027,[M+H]+,20.0,val,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1
454834,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1,327.07027,[M+H]+,20.0,val,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1
454835,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1,327.07027,[M+H]+,60.0,val,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1
454836,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1,327.07027,[M+H]+,30.0,val,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1
454837,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1,327.07027,[M+H]+,20.0,val,O=C(O)c1cc(Br)cc(NCCCN2CCCC2)c1
454838,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454839,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454840,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1,327.07027,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454841,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1,327.07027,[M+H]+,30.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454842,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1,327.07027,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC[C@@H]1c1cncc(Br)c1
454843,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,20.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454844,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,20.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454845,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,60.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454846,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,30.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454847,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,20.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454848,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,60.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454849,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,30.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454850,O=C(NCCCN1CCOCC1)c1ccccc1Br,327.07027,[M+H]+,20.0,val,O=C(NCCCN1CCOCC1)c1ccccc1Br
454851,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454852,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454853,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,60.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454854,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,30.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454855,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454856,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,60.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454857,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,30.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454858,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,345.06813,[M-H]-,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454859,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454860,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454861,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,60.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454862,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,30.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454863,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454864,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,60.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454865,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,30.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454866,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,345.06813,[M-H]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454867,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,381.04481,[M+Cl]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454868,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,381.04481,[M+Cl]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454869,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,381.04481,[M+Cl]-,60.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454870,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,381.04481,[M+Cl]-,15.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454871,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,381.04481,[M+Cl]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454872,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,391.07361,[M+FA]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454873,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,391.07361,[M+FA]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454874,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,391.07361,[M+FA]-,60.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454875,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,391.07361,[M+FA]-,15.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454876,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2,391.07361,[M+FA]-,20.0,val,CC(NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)C1CC2CCC1C2
454877,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,347.08268,[M+H]+,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454878,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,347.08268,[M+H]+,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454879,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,347.08268,[M+H]+,60.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454880,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,347.08268,[M+H]+,15.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454881,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1,347.08268,[M+H]+,20.0,val,O=C(O)C(CNS(=O)(=O)N1CCCC1)Cc1ccc(Cl)cc1
454882,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1,318.0981,[M-H]-,20.0,val,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1
454883,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1,318.0981,[M-H]-,20.0,val,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1
454884,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1,318.0981,[M-H]-,60.0,val,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1
454885,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1,318.0981,[M-H]-,20.0,val,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1
454886,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1,318.0981,[M-H]-,60.0,val,O=S(=O)(NC1CCCCCC1)c1ccc(OC(F)F)cc1
454887,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454888,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454889,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,30.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454890,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,60.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454891,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454892,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,45.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454893,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,60.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454894,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,351.09957,[M-H]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454895,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,387.07625,[M+Cl]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454896,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,387.07625,[M+Cl]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454897,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,387.07625,[M+Cl]-,60.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454898,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,387.07625,[M+Cl]-,15.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454899,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,387.07625,[M+Cl]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454900,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,397.10505,[M+FA]-,30.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454901,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,397.10505,[M+FA]-,30.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454902,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,397.10505,[M+FA]-,60.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454903,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,397.10505,[M+FA]-,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454904,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,397.10505,[M+FA]-,30.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454905,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,353.11412,[M+H]+,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454906,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,353.11412,[M+H]+,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454907,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,353.11412,[M+H]+,60.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454908,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,353.11412,[M+H]+,30.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454909,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1,353.11412,[M+H]+,20.0,val,CCCCN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1
454910,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,20.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454911,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,20.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454912,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,60.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454913,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,30.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454914,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,20.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454915,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,30.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454916,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,20.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454917,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1,353.11412,[M+H]+,60.0,val,CC(C)S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)C1
454918,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454919,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454920,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,60.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454921,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,30.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454922,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454923,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,60.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454924,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,30.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454925,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,331.13873,[M-H]-,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454926,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454927,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454928,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,30.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454929,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454930,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454931,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454932,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454933,CC(C)[C@H](NC(=O)N1CCc2c(C1)ncn(C)c2=O)C(F)(F)F,333.15329,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)N1CCc2c(ncn(C)c2=O)C1)C(F)(F)F
454934,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454935,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454936,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,30.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454937,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,60.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454938,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,15.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454939,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454940,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,60.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454941,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1,333.15329,[M+H]+,20.0,val,Cc1c[nH]c(=O)c(CNC(=O)NC2CCN(CC(F)(F)F)C2)c1
454942,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,347.13365,[M-H]-,30.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454943,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,347.13365,[M-H]-,30.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454944,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,347.13365,[M-H]-,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454945,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,347.13365,[M-H]-,60.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454946,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,347.13365,[M-H]-,30.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454947,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,383.11033,[M+Cl]-,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454948,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,383.11033,[M+Cl]-,15.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454949,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,393.13913,[M+FA]-,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454950,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,393.13913,[M+FA]-,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454951,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,393.13913,[M+FA]-,60.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454952,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,393.13913,[M+FA]-,15.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454953,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,393.13913,[M+FA]-,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454954,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,349.1482,[M+H]+,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454955,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,349.1482,[M+H]+,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454956,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,349.1482,[M+H]+,60.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454957,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,349.1482,[M+H]+,15.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454958,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F,349.1482,[M+H]+,20.0,val,CC1CN(C(=O)NCc2ccc(C(N)=O)o2)CCN1CC(F)(F)F
454959,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454960,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454961,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454962,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454963,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454964,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,45.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454965,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454966,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F,315.11732,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CC(N3CCCC3)C2)cc1F
454967,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454968,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454969,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,60.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454970,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454971,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,45.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454972,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,60.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454973,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454974,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,341.10891,[M-H]-,45.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454975,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,377.08559,[M+Cl]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454976,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,377.08559,[M+Cl]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454977,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,377.08559,[M+Cl]-,60.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454978,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,377.08559,[M+Cl]-,15.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454979,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,377.08559,[M+Cl]-,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454980,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454981,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454982,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,30.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454983,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,60.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454984,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,15.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454985,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454986,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,60.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454987,C[C@@H](CO)NS(=O)(=O)c1c(NCc2nn(C)cc2)ccc(F)c1,343.12347,[M+H]+,20.0,val,C[C@@H](CO)NS(=O)(=O)c1cc(F)ccc1NCc1ccn(C)n1
454988,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454989,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,60.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454990,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,15.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454991,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454992,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454993,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454994,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,60.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454995,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,15.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454996,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454997,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,60.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454998,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,15.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
454999,CCN(CC)CCc1nc(-c2ccccc2)no1,246.16009,[M+H]+,20.0,val,CCN(CC)CCc1nc(-c2ccccc2)no1
455000,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,292.13028,[M-H]-,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455001,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,292.13028,[M-H]-,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455002,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,292.13028,[M-H]-,60.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455003,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,292.13028,[M-H]-,30.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455004,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,292.13028,[M-H]-,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455005,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,294.14483,[M+H]+,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455006,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,294.14483,[M+H]+,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455007,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,294.14483,[M+H]+,30.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455008,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,294.14483,[M+H]+,60.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455009,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1,294.14483,[M+H]+,20.0,val,Cc1cc(C(=O)N(CCC(=O)O)CC2CCCO2)ncn1
455010,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455011,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455012,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,60.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455013,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,30.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455014,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455015,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,60.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455016,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,30.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455017,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,292.13028,[M-H]-,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455018,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,294.14483,[M+H]+,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455019,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,294.14483,[M+H]+,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455020,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,294.14483,[M+H]+,60.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455021,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,294.14483,[M+H]+,15.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455022,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O,294.14483,[M+H]+,20.0,val,NC(=O)NCCCC(NC(=O)Cc1ccccc1)C(=O)O
455023,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,308.1252,[M-H]-,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455024,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,308.1252,[M-H]-,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455025,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,308.1252,[M-H]-,60.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455026,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,308.1252,[M-H]-,15.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455027,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,308.1252,[M-H]-,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455028,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],308.1252,[M-H]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455029,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],308.1252,[M-H]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455030,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],308.1252,[M-H]-,60.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455031,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],308.1252,[M-H]-,30.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455032,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],308.1252,[M-H]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455033,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],344.10187,[M+Cl]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455034,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],344.10187,[M+Cl]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455035,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],344.10187,[M+Cl]-,60.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455036,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],344.10187,[M+Cl]-,15.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455037,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],344.10187,[M+Cl]-,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455038,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455039,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455040,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,30.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455041,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,60.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455042,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,15.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455043,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455044,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,60.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455045,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-],310.13975,[M+H]+,20.0,val,O=C(CCN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-]
455046,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,310.13975,[M+H]+,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455047,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,310.13975,[M+H]+,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455048,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,310.13975,[M+H]+,60.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455049,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,310.13975,[M+H]+,30.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455050,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1,310.13975,[M+H]+,20.0,val,CC(C)c1nc(C2CN(C(=O)C3(C(=O)O)CC3)CCO2)no1
455051,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,312.10888,[M-H]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455052,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,312.10888,[M-H]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455053,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,312.10888,[M-H]-,60.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455054,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,312.10888,[M-H]-,30.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455055,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,312.10888,[M-H]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455056,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455057,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455058,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,60.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455059,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,15.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455060,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455061,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,60.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455062,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,15.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455063,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,358.11435,[M+FA]-,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455064,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,314.12343,[M+H]+,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455065,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,314.12343,[M+H]+,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455066,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,314.12343,[M+H]+,60.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455067,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,314.12343,[M+H]+,30.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455068,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,314.12343,[M+H]+,20.0,val,NC(=O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
455069,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455070,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455071,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,60.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455072,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,30.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455073,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455074,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455075,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455076,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,60.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455077,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,30.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455078,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455079,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,60.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455080,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,30.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455081,CN(Cc1c(N)c(Br)cc(Br)c1)C1CCCCC1,375.0066,[M+H]+,20.0,val,CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1
455082,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,20.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455083,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,20.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455084,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,30.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455085,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,60.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455086,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,15.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455087,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,20.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455088,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,60.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455089,Clc1cccc(Cl)c1CNCCCN1CCOCC1,303.10254,[M+H]+,20.0,val,Clc1cccc(Cl)c1CNCCCN1CCOCC1
455090,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1,303.10254,[M+H]+,20.0,val,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1
455091,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1,303.10254,[M+H]+,20.0,val,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1
455092,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1,303.10254,[M+H]+,60.0,val,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1
455093,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1,303.10254,[M+H]+,30.0,val,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1
455094,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1,303.10254,[M+H]+,20.0,val,COc1c(Cl)cc(Cl)cc1CNCC1CCNCC1
455095,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,324.12328,[M-H]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455096,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,324.12328,[M-H]-,15.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455097,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,324.12328,[M-H]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455098,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,324.12328,[M-H]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455099,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,324.12328,[M-H]-,60.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455100,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455101,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455102,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,15.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455103,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455104,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,15.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455105,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,360.09995,[M+Cl]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455106,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455107,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455108,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,60.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455109,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,15.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455110,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455111,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,15.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455112,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455113,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,370.12876,[M+FA]-,60.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455114,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455115,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455116,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,60.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455117,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,30.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455118,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455119,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,60.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455120,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,30.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455121,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1,326.13783,[M+H]+,20.0,val,CCCCn1nnnc1NCc1cc(Cl)c(OC)c(OC)c1
455122,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455123,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455124,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455125,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,30.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455126,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455127,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455128,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,30.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455129,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,329.14307,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455130,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,365.11975,[M+Cl]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455131,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,365.11975,[M+Cl]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455132,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,365.11975,[M+Cl]-,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455133,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,365.11975,[M+Cl]-,15.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455134,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,365.11975,[M+Cl]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455135,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,375.14855,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455136,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,375.14855,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455137,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,375.14855,[M+FA]-,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455138,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,375.14855,[M+FA]-,15.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455139,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,375.14855,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455140,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455141,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455142,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455143,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,30.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455144,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455145,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,60.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455146,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,30.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455147,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F,331.15762,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CCOC(C3CCCO3)C2)c1C(F)F
455148,CCCC[C@](C)(CO)Nc1c2ncc(F)cc2nc(N)n1,294.17246,[M+H]+,20.0,val,CCCC[C@](C)(CO)Nc1nc(N)nc2cc(F)cnc12
455149,CCCC[C@](C)(CO)Nc1c2ncc(F)cc2nc(N)n1,294.17246,[M+H]+,20.0,val,CCCC[C@](C)(CO)Nc1nc(N)nc2cc(F)cnc12
455150,CCCC[C@](C)(CO)Nc1c2ncc(F)cc2nc(N)n1,294.17246,[M+H]+,60.0,val,CCCC[C@](C)(CO)Nc1nc(N)nc2cc(F)cnc12
455151,CCCC[C@](C)(CO)Nc1c2ncc(F)cc2nc(N)n1,294.17246,[M+H]+,30.0,val,CCCC[C@](C)(CO)Nc1nc(N)nc2cc(F)cnc12
455152,CCCC[C@](C)(CO)Nc1c2ncc(F)cc2nc(N)n1,294.17246,[M+H]+,20.0,val,CCCC[C@](C)(CO)Nc1nc(N)nc2cc(F)cnc12
455153,COC1(CC(=O)Nc2cccc(CN)c2)CCC1,249.15975,[M+H]+,20.0,val,COC1(CC(=O)Nc2cccc(CN)c2)CCC1
455154,COC1(CC(=O)Nc2cccc(CN)c2)CCC1,249.15975,[M+H]+,20.0,val,COC1(CC(=O)Nc2cccc(CN)c2)CCC1
455155,COC1(CC(=O)Nc2cccc(CN)c2)CCC1,249.15975,[M+H]+,60.0,val,COC1(CC(=O)Nc2cccc(CN)c2)CCC1
455156,COC1(CC(=O)Nc2cccc(CN)c2)CCC1,249.15975,[M+H]+,15.0,val,COC1(CC(=O)Nc2cccc(CN)c2)CCC1
455157,COC1(CC(=O)Nc2cccc(CN)c2)CCC1,249.15975,[M+H]+,20.0,val,COC1(CC(=O)Nc2cccc(CN)c2)CCC1
455158,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,20.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455159,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,20.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455160,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,60.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455161,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,30.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455162,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,20.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455163,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,60.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455164,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,30.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455165,CCC1CN(C)c2ccccc2CN1CC(=O)O,249.15975,[M+H]+,20.0,val,CCC1CN(C)c2ccccc2CN1CC(=O)O
455166,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,248.15193,[M]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455167,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,248.15193,[M]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455168,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,248.15193,[M]+,60.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455169,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,248.15193,[M]+,30.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455170,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,248.15193,[M]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455171,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455172,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455173,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,60.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455174,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455175,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,45.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455176,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,60.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455177,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,20.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455178,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2,249.15975,[M+H]+,45.0,val,Cc1cc(C(=O)O)c(C)n1C1CN2CCC1CC2
455179,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455180,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455181,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,60.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455182,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,30.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455183,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455184,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,60.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455185,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,30.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455186,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455187,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455188,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455189,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,60.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455190,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,30.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455191,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455192,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,60.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455193,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,30.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455194,CC(C)NCC(O)COc1c2cc[nH]c2ccc1,249.15975,[M+H]+,20.0,val,CC(C)NCC(O)COc1cccc2[nH]ccc12
455195,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455196,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455197,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,60.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455198,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,30.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455199,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455200,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,60.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455201,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,30.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455202,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455203,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,315.11171,[M+Cl]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455204,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,315.11171,[M+Cl]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455205,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,315.11171,[M+Cl]-,60.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455206,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,315.11171,[M+Cl]-,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455207,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455208,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455209,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,60.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455210,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,15.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455211,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455212,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,60.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455213,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,15.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455214,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,281.14958,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
455215,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455216,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455217,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,30.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455218,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,60.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455219,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,15.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455220,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455221,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,60.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455222,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cnccc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)N(CCC(=O)O)Cc1cccnc1
455223,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O
455224,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O
455225,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O,279.13503,[M-H]-,60.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O
455226,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O,279.13503,[M-H]-,15.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O
455227,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1cccc(N)c1)C(=O)O
455228,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455229,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455230,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,279.13503,[M-H]-,60.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455231,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,279.13503,[M-H]-,30.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455232,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,279.13503,[M-H]-,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455233,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,279.13503,[M-H]-,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455234,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,279.13503,[M-H]-,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455235,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,279.13503,[M-H]-,60.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455236,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,279.13503,[M-H]-,15.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455237,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,279.13503,[M-H]-,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455238,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,20.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455239,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,20.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455240,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,30.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455241,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,60.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455242,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,15.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455243,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,20.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455244,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,60.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455245,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1,281.14958,[M+H]+,20.0,val,CCOC(=O)C(NC(=O)OC(C)(C)C)c1ccncc1
455246,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455247,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455248,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,60.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455249,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,30.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455250,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455251,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,60.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455252,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,30.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455253,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1,281.14958,[M+H]+,20.0,val,Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccn1
455254,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455255,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455256,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,281.14958,[M+H]+,45.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455257,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,281.14958,[M+H]+,60.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455258,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1,281.14958,[M+H]+,20.0,val,CC(C)(C)OC(=O)Nc1ccc(C(N)CC(=O)O)cc1
455259,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,20.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455260,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,20.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455261,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,60.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455262,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,15.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455263,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,20.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455264,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,45.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455265,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,60.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455266,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1,341.11004,[M+H]+,20.0,val,O=C(C1CN(c2nnc(C3CC3)s2)CCO1)N1CCSCC1
455267,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,355.09041,[M-H]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455268,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,355.09041,[M-H]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455269,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,355.09041,[M-H]-,60.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455270,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,355.09041,[M-H]-,30.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455271,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,355.09041,[M-H]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455272,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,391.06708,[M+Cl]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455273,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,391.06708,[M+Cl]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455274,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,391.06708,[M+Cl]-,60.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455275,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,391.06708,[M+Cl]-,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455276,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455277,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455278,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,60.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455279,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,15.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455280,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455281,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,60.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455282,Cc1c(C)c2c(N)nc(SCC(=O)NCCOCCO)nc2s1,357.10496,[M+H]+,20.0,val,Cc1sc2nc(SCC(=O)NCCOCCO)nc(N)c2c1C
455283,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O,321.16697,[M+H]+,20.0,val,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O
455284,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O,321.16697,[M+H]+,20.0,val,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O
455285,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O,321.16697,[M+H]+,60.0,val,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O
455286,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O,321.16697,[M+H]+,15.0,val,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O
455287,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O,321.16697,[M+H]+,20.0,val,CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncn[nH]1)C2=O
455288,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,365.15789,[M+FA]-,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455289,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,365.15789,[M+FA]-,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455290,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,365.15789,[M+FA]-,60.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455291,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,365.15789,[M+FA]-,15.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455292,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,365.15789,[M+FA]-,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455293,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,321.16696,[M+H]+,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455294,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,321.16696,[M+H]+,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455295,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,321.16696,[M+H]+,60.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455296,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,321.16696,[M+H]+,20.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455297,CCn1nnc2c1ncn(CC(=O)N1CC(C)OC(C)C1)c2=O,321.16696,[M+H]+,45.0,val,CCn1nnc2c(=O)n(CC(=O)N3CC(C)OC(C)C3)cnc21
455298,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455299,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,15.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455300,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,60.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455301,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455302,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,60.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455303,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,362.09468,[M+Cl]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455304,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455305,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455306,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,60.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455307,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,15.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455308,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455309,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,60.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455310,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,15.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455311,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,372.12348,[M+FA]-,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455312,COc1cc(N2CCN(S(=O)(=O)C3CCOC3)CC2)ncc1,328.13255,[M+H]+,20.0,val,COc1ccnc(N2CCN(S(=O)(=O)C3CCOC3)CC2)c1
455313,COc1cc(N2CCN(S(=O)(=O)C3CCOC3)CC2)ncc1,328.13255,[M+H]+,20.0,val,COc1ccnc(N2CCN(S(=O)(=O)C3CCOC3)CC2)c1
455314,COc1cc(N2CCN(S(=O)(=O)C3CCOC3)CC2)ncc1,328.13255,[M+H]+,60.0,val,COc1ccnc(N2CCN(S(=O)(=O)C3CCOC3)CC2)c1
455315,COc1cc(N2CCN(S(=O)(=O)C3CCOC3)CC2)ncc1,328.13255,[M+H]+,20.0,val,COc1ccnc(N2CCN(S(=O)(=O)C3CCOC3)CC2)c1
455316,COc1cc(N2CCN(S(=O)(=O)C3CCOC3)CC2)ncc1,328.13255,[M+H]+,45.0,val,COc1ccnc(N2CCN(S(=O)(=O)C3CCOC3)CC2)c1
455317,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,328.13255,[M+H]+,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455318,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,328.13255,[M+H]+,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455319,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,328.13255,[M+H]+,60.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455320,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,328.13255,[M+H]+,20.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455321,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O,328.13255,[M+H]+,45.0,val,CN(c1cccc(CNC(=O)NC2(C)COC2)c1)S(C)(=O)=O
455322,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,20.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455323,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,20.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455324,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,60.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455325,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,30.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455326,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,20.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455327,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,60.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455328,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,30.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455329,CCOc1c(S(=O)(=O)N2CCCN(C(C)=O)CC2)cncc1,328.13255,[M+H]+,20.0,val,CCOc1ccncc1S(=O)(=O)N1CCCN(C(C)=O)CC1
455330,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455331,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455332,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,326.118,[M-H]-,60.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455333,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455334,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,326.118,[M-H]-,45.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455335,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455336,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455337,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,328.13255,[M+H]+,60.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455338,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,328.13255,[M+H]+,30.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455339,CN(C)S(=O)(=O)Nc1cc(OC(=O)N2CCCCC2)ccc1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455340,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455341,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455342,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455343,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455344,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455345,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455346,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455347,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,326.118,[M-H]-,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455348,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,372.12348,[M+FA]-,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455349,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,372.12348,[M+FA]-,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455350,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,372.12348,[M+FA]-,60.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455351,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,372.12348,[M+FA]-,15.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455352,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,372.12348,[M+FA]-,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455353,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455354,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455355,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,326.118,[M-H]-,45.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455356,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,326.118,[M-H]-,60.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455357,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,326.118,[M-H]-,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455358,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455359,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455360,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,60.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455361,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,30.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455362,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455363,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,30.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455364,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,60.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455365,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NCC1CCN(S(=O)(=O)c2cccnc2)CC1
455366,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455367,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455368,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,60.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455369,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,30.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455370,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455371,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,30.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455372,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,20.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455373,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1,328.13255,[M+H]+,60.0,val,CN(C)S(=O)(=O)Nc1cccc(OC(=O)N2CCCCC2)c1
455374,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O,328.13255,[M+H]+,20.0,val,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O
455375,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O,328.13255,[M+H]+,20.0,val,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O
455376,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O,328.13255,[M+H]+,60.0,val,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O
455377,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O,328.13255,[M+H]+,15.0,val,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O
455378,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O,328.13255,[M+H]+,20.0,val,Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O
455379,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,20.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455380,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,20.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455381,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,30.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455382,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,60.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455383,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,20.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455384,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,20.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455385,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O,328.13255,[M+H]+,60.0,val,CCN1CCCn2cc(S(=O)(=O)N3CCOCC3)cc2C1=O
455386,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455387,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455388,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455389,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455390,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455391,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,45.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455392,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455393,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455394,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1,328.13255,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1NC1CCCCC1
455395,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,328.13255,[M+H]+,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455396,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,328.13255,[M+H]+,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455397,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,328.13255,[M+H]+,45.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455398,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,328.13255,[M+H]+,60.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455399,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1,328.13255,[M+H]+,20.0,val,COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCN(C)CC1
455400,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,258.17242,[M-H]-,45.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455401,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,258.17242,[M-H]-,45.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455402,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,258.17242,[M-H]-,60.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455403,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,258.17242,[M-H]-,45.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455404,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,20.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455405,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,20.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455406,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,60.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455407,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,20.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455408,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,45.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455409,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,60.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455410,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,20.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455411,CCCN1CCC(CNc2c3nc[nH]c3ccn2)C1,260.18697,[M+H]+,45.0,val,CCCN1CCC(CNc2nccc3[nH]cnc23)C1
455412,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,20.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455413,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,20.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455414,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,60.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455415,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,20.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455416,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,45.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455417,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,60.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455418,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,20.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455419,CC(C)c1nccc(Nc2cn(C(C)(C)C)nc2)n1,260.18697,[M+H]+,45.0,val,CC(C)c1nccc(Nc2cnn(C(C)(C)C)c2)n1
455420,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1,260.18697,[M+H]+,20.0,val,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1
455421,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1,260.18697,[M+H]+,20.0,val,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1
455422,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1,260.18697,[M+H]+,60.0,val,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1
455423,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1,260.18697,[M+H]+,20.0,val,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1
455424,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1,260.18697,[M+H]+,60.0,val,CC(C)(C)c1ccc2nnc(C3CCNCC3)n2n1
455425,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,20.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455426,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,20.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455427,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,45.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455428,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,60.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455429,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,20.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455430,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,45.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455431,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,20.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455432,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12,260.18697,[M+H]+,60.0,val,C[C@@H]1CCN(C)C[C@@H]1N(C)c1ncnc2[nH]ccc12
455433,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455434,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455435,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,60.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455436,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455437,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,45.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455438,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455439,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455440,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,60.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455441,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455442,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,45.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455443,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,60.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455444,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,20.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455445,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1,282.11694,[M-H]-,45.0,val,CC(C)Cc1ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc1
455446,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,323.13434,[M+Cl]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455447,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,323.13434,[M+Cl]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455448,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455449,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455450,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,60.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455451,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,15.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455452,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455453,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,60.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455454,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,15.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455455,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,333.16314,[M+FA]-,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455456,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,289.17221,[M+H]+,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455457,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,289.17221,[M+H]+,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455458,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,289.17221,[M+H]+,60.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455459,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,289.17221,[M+H]+,30.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455460,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2,289.17221,[M+H]+,20.0,val,O=C(NC1CCC(F)(F)CC1)NC1CC12CCOCC2
455461,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,351.17863,[M+FA]-,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455462,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,351.17863,[M+FA]-,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455463,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,351.17863,[M+FA]-,60.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455464,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,351.17863,[M+FA]-,15.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455465,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,351.17863,[M+FA]-,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455466,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455467,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455468,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,60.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455469,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455470,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,45.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455471,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,60.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455472,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455473,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,271.16658,[M+H-2H2O]+,45.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455474,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,307.1877,[M+H]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455475,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,307.1877,[M+H]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455476,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,307.1877,[M+H]+,60.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455477,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,307.1877,[M+H]+,30.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455478,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1,307.1877,[M+H]+,20.0,val,O=C(Nc1n[nH]nc1C(=O)N1CCCC1)N1CCCCCC1
455479,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,20.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455480,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,20.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455481,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,30.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455482,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,60.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455483,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,15.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455484,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,20.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455485,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,60.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455486,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1,307.1877,[M+H]+,20.0,val,CC(C(=O)NC(N)=O)N1CCCC(c2n[nH]c(C3CC3)n2)C1
455487,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,307.1877,[M+H]+,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455488,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,307.1877,[M+H]+,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455489,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,307.1877,[M+H]+,60.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455490,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,307.1877,[M+H]+,30.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455491,Cc1nc(C(C)(C)NC(=O)Nc2cn(C(C)(C)C)nc2)no1,307.1877,[M+H]+,20.0,val,Cc1nc(C(C)(C)NC(=O)Nc2cnn(C(C)(C)C)c2)no1
455492,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,20.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455493,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,20.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455494,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,60.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455495,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,20.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455496,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,45.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455497,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,60.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455498,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,20.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455499,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1,307.1877,[M+H]+,45.0,val,CCN(CCO)c1nc(N2CCOCC2)c2cnn(C)c2n1
455500,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455501,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455502,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455503,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,15.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455504,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455505,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,343.14056,[M+Cl]-,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455506,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455507,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455508,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,15.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455509,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455510,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455511,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,15.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455512,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,353.16937,[M+FA]-,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455513,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455514,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455515,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455516,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,30.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455517,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455518,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,60.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455519,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,30.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455520,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,309.17844,[M+H]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455521,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,331.16038,[M+Na]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455522,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,331.16038,[M+Na]+,30.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455523,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1,331.16038,[M+Na]+,20.0,val,O=C(NCC1CCCC(C(F)(F)F)C1)NC[C@H]1CCCO1
455524,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455525,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455526,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455527,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,30.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455528,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455529,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455530,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,30.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455531,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,296.14382,[M-H]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455532,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,332.1205,[M+Cl]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455533,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,332.1205,[M+Cl]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455534,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,332.1205,[M+Cl]-,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455535,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,332.1205,[M+Cl]-,15.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455536,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,332.1205,[M+Cl]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455537,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,342.1493,[M+FA]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455538,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,342.1493,[M+FA]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455539,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,342.1493,[M+FA]-,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455540,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,342.1493,[M+FA]-,15.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455541,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,342.1493,[M+FA]-,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455542,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1,298.15837,[M+H]+,20.0,val,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1
455543,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1,298.15837,[M+H]+,20.0,val,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1
455544,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1,298.15837,[M+H]+,60.0,val,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1
455545,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1,298.15837,[M+H]+,30.0,val,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1
455546,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1,298.15837,[M+H]+,20.0,val,Cn1cc(CN2CCS(=O)(=O)CC2)c(C2CCCC2)n1
455547,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455548,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455549,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,60.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455550,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,15.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455551,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455552,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,60.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455553,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,15.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455554,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1,298.15837,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)N(C)C(C)c2ccccn2)CC1
455555,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455556,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455557,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,60.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455558,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,30.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455559,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455560,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,60.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455561,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,30.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455562,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1,298.15837,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CC[S+]([O-])CC1
455563,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455564,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455565,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455566,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,30.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455567,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455568,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,60.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455569,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,30.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455570,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1,298.15837,[M+H]+,20.0,val,CC(C)(C)c1cnc(NC(=O)NC2CC(O)C2(C)C)s1
455571,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,20.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455572,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,20.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455573,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,30.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455574,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,60.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455575,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,20.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455576,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,45.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455577,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,60.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455578,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C,298.15837,[M+H]+,20.0,val,CCc1c(C(=O)N2CC[S+]([O-])CC2)cnn1CC(C)C
455579,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455580,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455581,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,60.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455582,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,45.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455583,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,60.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455584,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,45.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455585,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455586,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455587,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,60.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455588,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455589,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,45.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455590,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,60.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455591,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455592,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,292.1779,[M-H]-,45.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455593,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,294.19245,[M+H]+,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455594,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,294.19245,[M+H]+,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455595,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,294.19245,[M+H]+,60.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455596,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,294.19245,[M+H]+,30.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455597,CC(C)C(C)NC(=O)C1CCN(C(=O)c2n[nH]nc2)CC1,294.19245,[M+H]+,20.0,val,CC(C)C(C)NC(=O)C1CCN(C(=O)c2cn[nH]n2)CC1
455598,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,20.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455599,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,20.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455600,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,30.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455601,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,60.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455602,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,15.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455603,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,20.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455604,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,60.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455605,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1,294.19245,[M+H]+,20.0,val,COCC(N)Cc1cn(Cc2coc(C(C)(C)C)n2)nn1
455606,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,20.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455607,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,20.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455608,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,60.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455609,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,30.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455610,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,20.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455611,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,60.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455612,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,30.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455613,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,294.19245,[M+H]+,20.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455614,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,316.17439,[M+Na]+,45.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455615,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,316.17439,[M+Na]+,20.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455616,CO[C@H]1CCN(C(=O)Nc2nn(C3CCCCC3)cn2)C1,316.17439,[M+Na]+,45.0,val,CO[C@H]1CCN(C(=O)Nc2ncn(C3CCCCC3)n2)C1
455617,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455618,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455619,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,60.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455620,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,30.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455621,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455622,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,60.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455623,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,30.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455624,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1,294.19245,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2ccnn2C)CC1
455625,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,20.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455626,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,20.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455627,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,60.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455628,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,30.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455629,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,20.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455630,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,60.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455631,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,30.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455632,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1,294.19245,[M+H]+,20.0,val,CC(C)NC(=O)CN1CCN(C(=O)c2cn(C)cn2)CC1
455633,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455634,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455635,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,60.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455636,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455637,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,45.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455638,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,60.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455639,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455640,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,45.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455641,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455642,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455643,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,45.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455644,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,60.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455645,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455646,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,60.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455647,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,20.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455648,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1,296.2081,[M+H]+,45.0,val,CCn1ccnc1N1CCN(CC(=O)NCCOC)CC1
455649,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,20.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455650,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,20.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455651,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,60.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455652,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,30.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455653,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,20.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455654,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,60.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455655,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,30.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455656,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1,288.16279,[M+H]+,20.0,val,CCCC1(C(=O)N2CCCC(S(C)(=O)=O)CC2)CC1
455657,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,20.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455658,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,20.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455659,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,60.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455660,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,30.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455661,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,20.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455662,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,20.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455663,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,30.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455664,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,286.166,[M-H]-,60.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455665,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455666,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455667,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,60.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455668,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,15.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455669,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455670,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,310.16249,[M+Na]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455671,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,310.16249,[M+Na]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455672,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,310.16249,[M+Na]+,60.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455673,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,310.16249,[M+Na]+,30.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455674,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C,310.16249,[M+Na]+,20.0,val,COC(=O)[C@H](C)[C@@H](O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455675,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,30.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455676,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,30.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455677,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,60.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455678,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,20.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455679,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C,288.18055,[M+H]+,30.0,val,CO[C@H]([C@@H](C)C(=O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C
455680,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,20.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455681,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,20.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455682,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,60.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455683,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,30.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455684,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,20.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455685,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,20.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455686,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,30.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455687,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1,274.20128,[M+H]+,60.0,val,CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1
455688,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455689,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455690,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,60.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455691,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,30.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455692,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455693,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,60.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455694,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,30.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455695,CC(=O)NCCCCCCCCCC(C)(C)O,226.21654,[M+H-H2O]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455696,CC(=O)NCCCCCCCCCC(C)(C)O,244.2271,[M+H]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455697,CC(=O)NCCCCCCCCCC(C)(C)O,244.2271,[M+H]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455698,CC(=O)NCCCCCCCCCC(C)(C)O,244.2271,[M+H]+,60.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455699,CC(=O)NCCCCCCCCCC(C)(C)O,244.2271,[M+H]+,15.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455700,CC(=O)NCCCCCCCCCC(C)(C)O,244.2271,[M+H]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455701,CC(=O)NCCCCCCCCCC(C)(C)O,266.20905,[M+Na]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455702,CC(=O)NCCCCCCCCCC(C)(C)O,266.20905,[M+Na]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455703,CC(=O)NCCCCCCCCCC(C)(C)O,266.20905,[M+Na]+,60.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455704,CC(=O)NCCCCCCCCCC(C)(C)O,266.20905,[M+Na]+,30.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455705,CC(=O)NCCCCCCCCCC(C)(C)O,266.20905,[M+Na]+,20.0,val,CC(=O)NCCCCCCCCCC(C)(C)O
455706,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455707,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455708,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455709,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455710,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455711,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455712,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455713,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455714,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455715,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455716,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455717,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455718,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455719,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455720,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455721,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455722,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455723,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455724,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455725,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455726,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455727,O=C(O)c1cc2c(cc1)nc(-c1cc(Cl)cc(Cl)c1)o2,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3cc(Cl)cc(Cl)c3)oc2c1
455728,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1
455729,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1
455730,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1,305.97302,[M-H]-,60.0,val,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1
455731,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1,305.97302,[M-H]-,30.0,val,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1
455732,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1,305.97302,[M-H]-,20.0,val,O=C(O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1
455733,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,331.93864,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455734,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,331.93864,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455735,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,331.93864,[M-H]-,60.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455736,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,331.93864,[M-H]-,30.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455737,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,331.93864,[M-H]-,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455738,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,333.95319,[M+H]+,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455739,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,333.95319,[M+H]+,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455740,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,333.95319,[M+H]+,60.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455741,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,333.95319,[M+H]+,20.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455742,O=C(O)c1cc2c(cc1)nc(-c1ccccc1Br)s2,333.95319,[M+H]+,60.0,val,O=C(O)c1ccc2nc(-c3ccccc3Br)sc2c1
455743,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455744,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455745,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,60.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455746,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455747,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,60.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455748,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455749,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O
455750,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O
455751,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O,239.03498,[M-H]-,60.0,val,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O
455752,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O
455753,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O,239.03498,[M-H]-,60.0,val,O=C1c2ccccc2C(=O)c2c1ccc(O)c2O
455754,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455755,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455756,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,60.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455757,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455758,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,60.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455759,O=C1c2c(cc(O)cc2)C(=O)c2c1cc(O)cc2,239.03498,[M-H]-,20.0,val,O=C1c2ccc(O)cc2C(=O)c2ccc(O)cc21
455760,O=C1c2c(C(=O)c3c1cccc3O)c(O)ccc2,285.04046,[M+FA]-,20.0,val,O=C1c2cccc(O)c2C(=O)c2c(O)cccc21
455761,O=C1c2c(C(=O)c3c1cccc3O)c(O)ccc2,285.04046,[M+FA]-,60.0,val,O=C1c2cccc(O)c2C(=O)c2c(O)cccc21
455762,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455763,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455764,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,60.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455765,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455766,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455767,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21,239.03498,[M-H]-,60.0,val,O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21
455768,O=C1c2ccccc2C(=O)c2c(O)c(O)c(S(=O)(=O)O)cc12,318.9918,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O
455769,O=C1c2ccccc2C(=O)c2c(O)c(O)c(S(=O)(=O)O)cc12,318.9918,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O
455770,O=C1c2ccccc2C(=O)c2c(O)c(O)c(S(=O)(=O)O)cc12,318.9918,[M-H]-,60.0,val,O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O
455771,O=C1c2ccccc2C(=O)c2c(O)c(O)c(S(=O)(=O)O)cc12,318.9918,[M-H]-,20.0,val,O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O
455772,O=C1c2ccccc2C(=O)c2c(O)c(O)c(S(=O)(=O)O)cc12,318.9918,[M-H]-,45.0,val,O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O
455773,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455774,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455775,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,60.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455776,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,30.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455777,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455778,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,30.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455779,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455780,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F,307.08012,[M+H]+,60.0,val,O=C(Nc1cccn2ncnc12)c1ccccc1C(F)(F)F
455781,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455782,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455783,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,30.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455784,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,60.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455785,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455786,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,45.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455787,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,20.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455788,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1,307.08012,[M+H]+,60.0,val,O=C(Nc1cccn2cnnc12)c1cccc(C(F)(F)F)c1
455789,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455790,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455791,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,60.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455792,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,30.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455793,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455794,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,30.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455795,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455796,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,319.01136,[M-H]-,60.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455797,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,20.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455798,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,20.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455799,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,60.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455800,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,30.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455801,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,20.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455802,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,60.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455803,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,20.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455804,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1,321.02592,[M+H]+,30.0,val,Fc1cccc(Cl)c1CSc1nnc(-c2ccccc2)o1
455805,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl,321.02592,[M+H]+,20.0,val,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl
455806,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl,321.02592,[M+H]+,20.0,val,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl
455807,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl,321.02592,[M+H]+,45.0,val,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl
455808,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl,321.02592,[M+H]+,60.0,val,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl
455809,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl,321.02592,[M+H]+,20.0,val,O=C(NCc1cccnc1)c1sc2cc(F)ccc2c1Cl
455810,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455811,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455812,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,60.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455813,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,30.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455814,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455815,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,30.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455816,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,60.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455817,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1,321.02592,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1nc2c(Cl)cccc2s1
455818,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455819,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455820,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455821,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455822,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455823,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455824,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455825,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455826,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455827,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455828,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,60.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455829,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455830,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,45.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455831,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455832,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455833,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455834,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455835,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455836,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455837,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455838,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455839,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455840,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,325.02233,[M-H]-,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455841,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455842,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455843,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455844,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455845,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455846,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,60.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455847,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,30.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455848,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12,327.03688,[M+H]+,20.0,val,O=c1nc(SCc2cccc3nsnc23)[nH]c2ccccc12
455849,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455850,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455851,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,45.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455852,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,60.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455853,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1,327.03688,[M+H]+,20.0,val,Cc1ccc(-c2nnc3sc(-c4cccs4)nn3c2=O)cc1
455854,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455855,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455856,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,60.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455857,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,30.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455858,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455859,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,30.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455860,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455861,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,305.06149,[M-H]-,60.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455862,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,307.07604,[M+H]+,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455863,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,307.07604,[M+H]+,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455864,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,307.07604,[M+H]+,45.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455865,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,307.07604,[M+H]+,60.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455866,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N,307.07604,[M+H]+,20.0,val,Cc1cc(Sc2ncn[nH]2)n2c(nc3ccccc32)c1C#N
455867,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12,307.07604,[M+H]+,20.0,val,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12
455868,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12,307.07604,[M+H]+,20.0,val,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12
455869,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12,307.07604,[M+H]+,60.0,val,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12
455870,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12,307.07604,[M+H]+,60.0,val,Cc1c(-c2ccnc3ncnn23)sc2nc3ccccc3n12
455871,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,360.96519,[M-H]-,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455872,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,360.96519,[M-H]-,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455873,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,360.96519,[M-H]-,60.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455874,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,360.96519,[M-H]-,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455875,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455876,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455877,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,60.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455878,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,15.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455879,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455880,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,60.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455881,CNC(=O)c1cc2c(cncc2Oc2ccc(Br)cc2)s1,362.97974,[M+H]+,20.0,val,CNC(=O)c1cc2c(Oc3ccc(Br)cc3)cncc2s1
455882,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,328.97536,[M-H]-,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455883,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,328.97536,[M-H]-,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455884,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,328.97536,[M-H]-,60.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455885,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,328.97536,[M-H]-,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455886,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,328.97536,[M-H]-,45.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455887,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455888,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455889,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,60.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455890,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455891,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,45.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455892,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,60.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455893,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,20.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455894,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1,330.98991,[M+H]+,45.0,val,Brc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
455895,O=C1CC(c2ccccc2)c2cc(Br)ccc2O1,300.98697,[M-H]-,20.0,val,O=C1CC(c2ccccc2)c2cc(Br)ccc2O1
455896,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F,308.04843,[M+H]+,20.0,val,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F
455897,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F,308.04843,[M+H]+,20.0,val,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F
455898,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F,308.04843,[M+H]+,45.0,val,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F
455899,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F,308.04843,[M+H]+,60.0,val,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F
455900,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F,308.04843,[M+H]+,20.0,val,O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccccc1F
455901,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455902,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455903,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,60.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455904,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,30.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455905,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455906,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,30.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455907,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455908,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,314.08589,[M-H]-,60.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455909,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455910,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455911,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,60.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455912,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,30.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455913,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455914,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455915,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,30.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455916,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,314.08589,[M-H]-,60.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455917,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,350.06257,[M+Cl]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455918,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,350.06257,[M+Cl]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455919,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,350.06257,[M+Cl]-,60.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455920,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,350.06257,[M+Cl]-,15.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455921,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,350.06257,[M+Cl]-,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455922,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,316.10044,[M+H]+,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455923,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,316.10044,[M+H]+,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455924,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,316.10044,[M+H]+,60.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455925,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,316.10044,[M+H]+,30.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455926,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F,316.10044,[M+H]+,20.0,val,O=C(Cc1nc(-c2ccccn2)n[nH]1)Nc1cc(F)ccc1F
455927,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455928,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455929,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,45.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455930,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,60.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455931,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455932,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,45.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455933,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,60.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455934,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1,316.10044,[M+H]+,20.0,val,O=C(Nc1ccc(F)c(F)c1)c1ccc2nnc(C3CC3)n2n1
455935,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455936,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455937,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,45.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455938,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,60.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455939,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455940,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,45.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455941,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,60.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455942,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,328.02199,[M-H]-,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455943,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455944,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455945,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,30.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455946,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,60.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455947,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,15.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455948,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455949,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,60.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455950,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1,330.03654,[M+H]+,20.0,val,O=C(Nc1cccc(NC(=O)c2cccs2)n1)c1cccs1
455951,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,404.96397,[M+Cl]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455952,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,404.96397,[M+Cl]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455953,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,404.96397,[M+Cl]-,60.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455954,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,404.96397,[M+Cl]-,15.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455955,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,404.96397,[M+Cl]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455956,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,414.99277,[M+FA]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455957,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,414.99277,[M+FA]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455958,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,414.99277,[M+FA]-,60.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455959,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,414.99277,[M+FA]-,15.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455960,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,414.99277,[M+FA]-,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455961,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,371.00185,[M+H]+,30.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455962,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,371.00185,[M+H]+,30.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455963,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,371.00185,[M+H]+,20.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455964,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1,371.00185,[M+H]+,30.0,val,O=C(NCC1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1)c1cccs1
455965,NNC(=O)c1nn(Cc2c(Cl)cc(Cl)cc2)c2ccccc12,335.04609,[M+H]+,20.0,val,NNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
455966,NNC(=O)c1nn(Cc2c(Cl)cc(Cl)cc2)c2ccccc12,335.04609,[M+H]+,20.0,val,NNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
455967,NNC(=O)c1nn(Cc2c(Cl)cc(Cl)cc2)c2ccccc12,335.04609,[M+H]+,60.0,val,NNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
455968,NNC(=O)c1nn(Cc2c(Cl)cc(Cl)cc2)c2ccccc12,335.04609,[M+H]+,30.0,val,NNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
455969,NNC(=O)c1nn(Cc2c(Cl)cc(Cl)cc2)c2ccccc12,335.04609,[M+H]+,20.0,val,NNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
455970,Clc1c(Cl)cc(C2CC(c3ccco3)n3ncnc3N2)cc1,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455971,Clc1c(Cl)cc(C2CC(c3ccco3)n3ncnc3N2)cc1,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455972,Clc1c(Cl)cc(C2CC(c3ccco3)n3ncnc3N2)cc1,335.04609,[M+H]+,60.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455973,Clc1c(Cl)cc(C2CC(c3ccco3)n3ncnc3N2)cc1,335.04609,[M+H]+,30.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455974,Clc1c(Cl)cc(C2CC(c3ccco3)n3ncnc3N2)cc1,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455975,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455976,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455977,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,60.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455978,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,30.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455979,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455980,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455981,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,30.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455982,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,333.03154,[M-H]-,60.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455983,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,335.04609,[M+H]+,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455984,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,335.04609,[M+H]+,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455985,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,335.04609,[M+H]+,45.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455986,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,335.04609,[M+H]+,60.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455987,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2,335.04609,[M+H]+,20.0,val,O=C1CCCC2=C1C(c1ccc(Cl)cc1Cl)n1ncnc1N2
455988,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455989,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455990,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl,335.04609,[M+H]+,60.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455991,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl,335.04609,[M+H]+,30.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455992,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl,335.04609,[M+H]+,20.0,val,Clc1ccc(C2CC(c3ccco3)n3ncnc3N2)cc1Cl
455993,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,360.05323,[M-H]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455994,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,360.05323,[M-H]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455995,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,360.05323,[M-H]-,15.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455996,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,360.05323,[M-H]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455997,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,360.05323,[M-H]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455998,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,406.05871,[M+FA]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
455999,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,406.05871,[M+FA]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456000,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,406.05871,[M+FA]-,60.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456001,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,406.05871,[M+FA]-,15.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456002,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,406.05871,[M+FA]-,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456003,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456004,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456005,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,60.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456006,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,30.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456007,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456008,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,60.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456009,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,30.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456010,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F,362.06778,[M+H]+,20.0,val,Cn1cc(C(F)(F)F)nc1-c1cc(C(=O)NC2CC2)c(Cl)cc1F
456011,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456012,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456013,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,45.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456014,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,60.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456015,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456016,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,45.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456017,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456018,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,332.0266,[M-H]-,60.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456019,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1,334.04115,[M+H]+,20.0,val,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1
456020,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1,334.04115,[M+H]+,20.0,val,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1
456021,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1,334.04115,[M+H]+,60.0,val,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1
456022,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1,334.04115,[M+H]+,30.0,val,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1
456023,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1,334.04115,[M+H]+,20.0,val,Cc1nc2scc(C)n2c(=O)c1NC(=O)c1ccc(Cl)cc1
456024,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,334.04115,[M+H]+,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456025,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,334.04115,[M+H]+,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456026,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,334.04115,[M+H]+,45.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456027,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,334.04115,[M+H]+,60.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456028,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1,334.04115,[M+H]+,20.0,val,CCc1nnc(NC(=O)c2ccc(-c3ccccc3Cl)o2)s1
456029,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1,326.09155,[M+H]+,20.0,val,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1
456030,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1,326.09155,[M+H]+,45.0,val,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1
456031,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1,326.09155,[M+H]+,20.0,val,Cc1cc(N)n(-c2ncnc3c2cnn3-c2cccc(Cl)c2)n1
456032,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,20.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456033,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,20.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456034,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,45.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456035,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,60.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456036,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,20.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456037,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,45.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456038,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,60.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456039,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1,317.0413,[M+H]+,20.0,val,c1cc(Cc2csc(Nc3ccc4c(c3)OCO4)n2)cs1
456040,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,20.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456041,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,20.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456042,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,60.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456043,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,30.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456044,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,20.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456045,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,60.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456046,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,30.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456047,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1,317.0413,[M+H]+,20.0,val,Cc1cccc(-c2nnc(SCC(=O)c3cccs3)o2)c1
456048,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,359.02781,[M-H]-,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456049,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,359.02781,[M-H]-,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456050,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,359.02781,[M-H]-,60.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456051,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,359.02781,[M-H]-,30.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456052,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,359.02781,[M-H]-,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456053,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,361.04236,[M+H]+,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456054,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,361.04236,[M+H]+,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456055,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,361.04236,[M+H]+,60.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456056,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,361.04236,[M+H]+,30.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456057,CSc1c(C#N)c(SCC(=O)c2cc3c(cc2)OCO3)nc(N)n1,361.04236,[M+H]+,20.0,val,CSc1nc(N)nc(SCC(=O)c2ccc3c(c2)OCO3)c1C#N
456058,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,45.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456059,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,45.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456060,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,20.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456061,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,60.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456062,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,45.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456063,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,30.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456064,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,30.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456065,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,20.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456066,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,60.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456067,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1,273.04023,[M+H]+,30.0,val,O=C1/C(=C/c2cccs2)CC/C1=C\c1cccs1
456068,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1,346.98592,[M-H]-,20.0,val,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1
456069,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1,346.98592,[M-H]-,20.0,val,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1
456070,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1,346.98592,[M-H]-,60.0,val,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1
456071,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1,346.98592,[M-H]-,30.0,val,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1
456072,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1,346.98592,[M-H]-,20.0,val,O=C(NC(=S)NCc1ccccc1)c1ccc(Br)cc1
456073,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456074,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456075,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,30.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456076,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,60.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456077,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456078,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,45.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456079,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,60.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456080,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,330.99101,[M-H]-,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456081,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456082,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456083,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,60.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456084,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,30.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456085,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456086,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,60.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456087,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,30.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456088,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1,333.00556,[M+H]+,20.0,val,Cc1ccc2nc(SCc3ccc(Br)cc3)[nH]c2c1
456089,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl,310.04632,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl
456090,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl,310.04632,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl
456091,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl,310.04632,[M+H]+,20.0,val,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl
456092,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl,310.04632,[M+H]+,60.0,val,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl
456093,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl,310.04632,[M+H]+,30.0,val,O=C(NCC1(c2ccsc2)CC1)c1ccc(F)cc1Cl
456094,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,20.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456095,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,20.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456096,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,60.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456097,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,30.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456098,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,20.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456099,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,30.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456100,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,60.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456101,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1,310.04632,[M+H]+,20.0,val,O=C(c1ccc(F)cc1Cl)N1CCC(c2cccs2)C1
456102,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl,310.04632,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl
456103,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl,310.04632,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl
456104,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl,310.04632,[M+H]+,60.0,val,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl
456105,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl,310.04632,[M+H]+,15.0,val,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl
456106,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl,310.04632,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CC1)c1c(F)cccc1Cl
456107,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,303.05419,[M-H]-,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456108,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,303.05419,[M-H]-,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456109,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,303.05419,[M-H]-,60.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456110,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,303.05419,[M-H]-,30.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456111,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,303.05419,[M-H]-,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456112,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456113,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456114,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,60.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456115,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456116,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,45.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456117,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,60.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456118,O=C(O)CN(C(=O)c1c2ccc(Cl)cc2ncc1)C1CC1,305.06875,[M+H]+,20.0,val,O=C(O)CN(C(=O)c1ccnc2cc(Cl)ccc12)C1CC1
456119,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,20.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456120,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,20.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456121,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,60.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456122,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,30.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456123,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,20.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456124,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,30.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456125,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,20.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456126,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1,305.06875,[M+H]+,60.0,val,COC(=O)c1cccc(C(=O)Nc2ccc(C)c(Cl)c2)n1
456127,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1,335.02627,[M-H]-,30.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1
456128,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1,335.02627,[M-H]-,30.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1
456129,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1,335.02627,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1
456130,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1,335.02627,[M-H]-,60.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1
456131,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1,335.02627,[M-H]-,30.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)c(Cl)c1
456132,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,283.0756,[M-H]-,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456133,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,283.0756,[M-H]-,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456134,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,283.0756,[M-H]-,60.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456135,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,283.0756,[M-H]-,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456136,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,283.0756,[M-H]-,45.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456137,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,285.09015,[M+H]+,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456138,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,285.09015,[M+H]+,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456139,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,285.09015,[M+H]+,60.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456140,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,285.09015,[M+H]+,20.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456141,Cc1c(Cl)cc(Nc2nc3ccccc3c(N)n2)cc1,285.09015,[M+H]+,60.0,val,Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
456142,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,343.05382,[M-H]-,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456143,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,343.05382,[M-H]-,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456144,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,343.05382,[M-H]-,45.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456145,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,343.05382,[M-H]-,60.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456146,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,343.05382,[M-H]-,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456147,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456148,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456149,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,60.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456150,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,15.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456151,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456152,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,45.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456153,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,60.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456154,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1,345.06837,[M+H]+,20.0,val,CC(C)c1cc(-c2nnc3sc(-c4ccccc4Cl)nn23)n[nH]1
456155,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,424.04674,[M-H]-,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456156,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,424.04674,[M-H]-,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456157,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,424.04674,[M-H]-,60.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456158,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,424.04674,[M-H]-,15.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456159,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,424.04674,[M-H]-,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456160,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,426.0613,[M+H]+,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456161,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,426.0613,[M+H]+,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456162,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,426.0613,[M+H]+,60.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456163,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,426.0613,[M+H]+,15.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456164,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F,426.0613,[M+H]+,20.0,val,Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F
456165,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,20.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456166,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,20.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456167,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,60.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456168,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,30.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456169,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,20.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456170,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,60.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456171,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,30.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456172,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1c(F)ccc(F)c1,340.04606,[M-H]-,20.0,val,CC(NS(=O)(=O)c1cccc(C(=O)O)c1)c1cc(F)ccc1F
456173,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,20.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456174,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,20.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456175,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,60.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456176,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,30.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456177,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,20.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456178,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,60.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456179,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,30.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456180,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1,340.04606,[M-H]-,20.0,val,O=C(O)c1cccc(CNS(=O)(=O)c2ccc(C(F)F)cc2)c1
456181,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,20.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456182,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,20.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456183,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,15.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456184,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,60.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456185,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,30.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456186,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,20.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456187,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,60.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456188,CC(=O)c1cc(Oc2c(F)cc(F)cc2)c(NS(C)(=O)=O)cc1,340.04606,[M-H]-,20.0,val,CC(=O)c1ccc(NS(C)(=O)=O)c(Oc2ccc(F)cc2F)c1
456189,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456190,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456191,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,60.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456192,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,30.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456193,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456194,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,60.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456195,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,30.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456196,O=C(c1ccco1)N1CCN=C1SCc1cc(F)ccc1,305.07545,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN=C1SCc1cccc(F)c1
456197,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456198,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456199,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,60.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456200,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456201,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,45.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456202,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,60.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456203,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456204,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1,319.05581,[M-H]-,45.0,val,O=C1CCc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2N1
456205,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456206,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456207,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,60.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456208,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,30.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456209,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456210,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,30.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456211,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456212,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F,319.05581,[M-H]-,60.0,val,Cc1ccc(NS(=O)(=O)Cc2noc3ccccc23)cc1F
456213,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O,317.10444,[M+H]+,20.0,val,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O
456214,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O,317.10444,[M+H]+,20.0,val,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O
456215,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O,317.10444,[M+H]+,60.0,val,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O
456216,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O,317.10444,[M+H]+,30.0,val,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O
456217,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O,317.10444,[M+H]+,20.0,val,COC(=O)Cn1cnc2c(cnn2Cc2ccccc2F)c1=O
456218,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456219,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456220,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,60.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456221,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,30.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456222,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456223,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,60.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456224,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,30.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456225,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456226,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456227,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456228,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,60.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456229,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,30.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456230,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456231,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,60.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456232,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,30.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456233,N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)cc2)cc1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
456234,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456235,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456236,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,523.88613,[M-H]-,60.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456237,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,523.88613,[M-H]-,30.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456238,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,523.88613,[M-H]-,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456239,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456240,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456241,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,525.90068,[M+H]+,60.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456242,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,525.90068,[M+H]+,30.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456243,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O,525.90068,[M+H]+,20.0,val,N[C@@H](Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1)C(=O)O
456244,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456245,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456246,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,60.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456247,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,30.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456248,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456249,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,60.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456250,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,30.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456251,COC(=O)CSc1c2nc(C)sc2c(-c2ccccc2)nn1,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456252,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456253,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456254,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,60.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456255,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,30.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456256,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456257,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,30.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456258,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,60.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456259,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12,332.05219,[M+H]+,20.0,val,COC(=O)CSc1nnc(-c2ccccc2)c2sc(C)nc12
456260,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,330.07316,[M-H]-,20.0,val,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
456261,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,330.07316,[M-H]-,20.0,val,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
456262,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,330.07316,[M-H]-,60.0,val,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
456263,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,330.07316,[M-H]-,15.0,val,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
456264,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,330.07316,[M-H]-,20.0,val,O=C(O)CNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
456265,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456266,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456267,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,60.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456268,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,30.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456269,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456270,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,60.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456271,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,30.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456272,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456273,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456274,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456275,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,60.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456276,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,30.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456277,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456278,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456279,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456280,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,60.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456281,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,30.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456282,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1,315.04946,[M]+,20.0,val,O=C(NCCc1nccs1)c1cnc2c(S)cccc2c1
456283,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,314.04273,[M-H]-,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456284,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,314.04273,[M-H]-,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456285,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,314.04273,[M-H]-,60.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456286,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,314.04273,[M-H]-,30.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456287,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,314.04273,[M-H]-,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456288,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,20.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456289,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,20.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456290,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,60.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456291,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,15.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456292,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,20.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456293,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,20.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456294,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,15.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456295,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,314.04273,[M-H]-,60.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456296,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456297,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456298,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,60.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456299,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,30.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456300,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456301,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456302,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,30.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456303,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,314.04273,[M-H]-,60.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456304,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,350.01941,[M+Cl]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456305,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,350.01941,[M+Cl]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456306,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,350.01941,[M+Cl]-,60.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456307,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,350.01941,[M+Cl]-,15.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456308,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,350.01941,[M+Cl]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456309,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,360.04821,[M+FA]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456310,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,360.04821,[M+FA]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456311,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,360.04821,[M+FA]-,15.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456312,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,360.04821,[M+FA]-,60.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456313,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,360.04821,[M+FA]-,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456314,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,316.05728,[M+H]+,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456315,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,316.05728,[M+H]+,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456316,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,316.05728,[M+H]+,60.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456317,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,316.05728,[M+H]+,30.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456318,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1,316.05728,[M+H]+,20.0,val,O=C(CSCc1ccc2nsnc2c1)Nc1ccccc1
456319,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,20.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456320,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,20.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456321,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,60.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456322,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,30.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456323,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,20.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456324,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,60.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456325,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,30.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456326,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1,316.05728,[M+H]+,20.0,val,Cc1ccc(C(=O)NCc2nccnc2-c2ccsc2)s1
456327,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12,316.05728,[M+H]+,20.0,val,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12
456328,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12,316.05728,[M+H]+,20.0,val,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12
456329,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12,316.05728,[M+H]+,60.0,val,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12
456330,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12,316.05728,[M+H]+,15.0,val,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12
456331,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12,316.05728,[M+H]+,20.0,val,Cc1cc(SCC(=O)Nc2nccs2)nc2ccccc12
456332,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,316.05728,[M+H]+,30.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456333,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,316.05728,[M+H]+,30.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456334,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,316.05728,[M+H]+,20.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456335,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,316.05728,[M+H]+,60.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456336,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C,316.05728,[M+H]+,30.0,val,Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C
456337,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456338,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456339,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,60.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456340,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,30.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456341,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456342,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,30.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456343,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,60.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456344,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)Nc1nnc(Cc2ccccc2)s1
456345,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1
456346,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1
456347,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1,316.05728,[M+H]+,60.0,val,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1
456348,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1,316.05728,[M+H]+,30.0,val,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1
456349,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1,316.05728,[M+H]+,20.0,val,O=C(Cc1cccs1)NCc1nccnc1-c1cccs1
456350,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,20.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456351,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,20.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456352,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,60.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456353,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,20.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456354,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,60.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456355,Cc1cc(Nc2nc(-c3ccncc3)cs2)ccc1,268.09029,[M+H]+,20.0,val,Cc1cccc(Nc2nc(-c3ccncc3)cs2)c1
456356,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1,284.09283,[M+FA]-,20.0,val,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1
456357,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1,284.09283,[M+FA]-,60.0,val,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1
456358,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1,284.09283,[M+FA]-,20.0,val,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1
456359,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1,284.09283,[M+FA]-,20.0,val,N#CC(Cc1ccc(O)cc1)c1ccc(O)cc1
456360,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,378.99667,[M-H]-,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456361,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,378.99667,[M-H]-,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456362,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,378.99667,[M-H]-,60.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456363,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,378.99667,[M-H]-,30.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456364,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,378.99667,[M-H]-,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456365,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,425.00215,[M+FA]-,15.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456366,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,425.00215,[M+FA]-,15.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456367,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,381.01123,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456368,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,381.01123,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456369,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,381.01123,[M+H]+,30.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456370,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,381.01123,[M+H]+,60.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456371,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C,381.01123,[M+H]+,20.0,val,Cc1c(Br)c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)nn1C
456372,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,314.02983,[M-H]-,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456373,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,314.02983,[M-H]-,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456374,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,314.02983,[M-H]-,45.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456375,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,314.02983,[M-H]-,60.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456376,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,314.02983,[M-H]-,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456377,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456378,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456379,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,60.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456380,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,30.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456381,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456382,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,30.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456383,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,60.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456384,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1,316.04439,[M+H]+,20.0,val,Brc1ccc(CNCc2nc3ccccc3[nH]2)cc1
456385,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456386,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456387,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,60.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456388,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,30.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456389,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456390,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456391,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,30.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456392,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,339.01311,[M-H]-,60.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456393,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,374.98979,[M+Cl]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456394,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,374.98979,[M+Cl]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456395,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,374.98979,[M+Cl]-,15.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456396,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,374.98979,[M+Cl]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456397,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456398,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456399,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,60.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456400,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,15.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456401,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456402,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456403,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,15.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456404,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,385.01859,[M+FA]-,60.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456405,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,341.02767,[M+H]+,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456406,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,341.02767,[M+H]+,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456407,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,341.02767,[M+H]+,60.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456408,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,341.02767,[M+H]+,15.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456409,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1,341.02767,[M+H]+,20.0,val,O=C(NCC1(c2ccsc2)CC1)Nc1ccc(Cl)c(Cl)c1
456410,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,20.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456411,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,20.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456412,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,60.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456413,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,30.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456414,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,20.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456415,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,30.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456416,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,60.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456417,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1,341.02767,[M+H]+,20.0,val,O=C(c1cccs1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1
456418,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456419,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456420,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,60.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456421,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,15.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456422,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456423,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,60.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456424,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,15.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456425,CCOC(=O)c1nn(-c2c(Cl)cc(F)cc2)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456426,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456427,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456428,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O,325.07497,[M+H]+,60.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456429,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O,325.07497,[M+H]+,15.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456430,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O,325.07497,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccc(F)cc2Cl)c(C)c1C(C)=O
456431,CC(C)n1ncc2c1ncn(Cc1c(F)c(Cl)ccc1)c2=O,321.09129,[M+H]+,20.0,val,CC(C)n1ncc2c(=O)n(Cc3cccc(Cl)c3F)cnc21
456432,CC(C)n1ncc2c1ncn(Cc1c(F)c(Cl)ccc1)c2=O,321.09129,[M+H]+,20.0,val,CC(C)n1ncc2c(=O)n(Cc3cccc(Cl)c3F)cnc21
456433,CC(C)n1ncc2c1ncn(Cc1c(F)c(Cl)ccc1)c2=O,321.09129,[M+H]+,60.0,val,CC(C)n1ncc2c(=O)n(Cc3cccc(Cl)c3F)cnc21
456434,CC(C)n1ncc2c1ncn(Cc1c(F)c(Cl)ccc1)c2=O,321.09129,[M+H]+,30.0,val,CC(C)n1ncc2c(=O)n(Cc3cccc(Cl)c3F)cnc21
456435,CC(C)n1ncc2c1ncn(Cc1c(F)c(Cl)ccc1)c2=O,321.09129,[M+H]+,20.0,val,CC(C)n1ncc2c(=O)n(Cc3cccc(Cl)c3F)cnc21
456436,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456437,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456438,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456439,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,30.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456440,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456441,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,30.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456442,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456443,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1,308.05065,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1
456444,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,20.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456445,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,20.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456446,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,30.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456447,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,60.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456448,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,15.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456449,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,20.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456450,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,60.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456451,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1,308.05065,[M+H]+,20.0,val,O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1
456452,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456453,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456454,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,60.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456455,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,15.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456456,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456457,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456458,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456459,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,30.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456460,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,60.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456461,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,15.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456462,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456463,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,60.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456464,Cc1c(C(=O)c2ccc(Cl)cc2)n(C)c(CC(=O)O)c1,292.0735,[M+H]+,20.0,val,Cc1cc(CC(=O)O)n(C)c1C(=O)c1ccc(Cl)cc1
456465,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,383.06311,[M-H]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456466,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,383.06311,[M-H]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456467,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,383.06311,[M-H]-,60.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456468,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,383.06311,[M-H]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456469,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,383.06311,[M-H]-,45.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456470,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,429.06858,[M+FA]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456471,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,429.06858,[M+FA]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456472,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,429.06858,[M+FA]-,60.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456473,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,429.06858,[M+FA]-,15.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456474,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,429.06858,[M+FA]-,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456475,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,385.07766,[M+H]+,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456476,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,385.07766,[M+H]+,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456477,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,385.07766,[M+H]+,60.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456478,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,385.07766,[M+H]+,30.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456479,COc1c(-c2cn3nc(C)c(S(N)(=O)=O)c3nc2)ccc(OC(F)F)c1,385.07766,[M+H]+,20.0,val,COc1cc(OC(F)F)ccc1-c1cnc2c(S(N)(=O)=O)c(C)nn2c1
456480,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456481,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456482,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,60.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456483,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,30.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456484,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456485,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,60.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456486,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,30.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456487,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,340.09145,[M-H]-,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456488,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,340.09145,[M-H]-,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456489,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,340.09145,[M-H]-,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456490,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,340.09145,[M-H]-,60.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456491,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,340.09145,[M-H]-,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456492,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,340.09145,[M-H]-,45.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456493,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456494,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456495,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456496,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456497,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,45.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456498,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456499,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456500,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,340.09145,[M-H]-,45.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456501,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,376.06813,[M+Cl]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456502,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,376.06813,[M+Cl]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456503,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,376.06813,[M+Cl]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456504,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,376.06813,[M+Cl]-,15.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456505,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,376.06813,[M+Cl]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456506,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,386.09693,[M+FA]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456507,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,386.09693,[M+FA]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456508,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,386.09693,[M+FA]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456509,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,386.09693,[M+FA]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456510,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,342.106,[M+H]+,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456511,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,342.106,[M+H]+,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456512,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,342.106,[M+H]+,60.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456513,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,342.106,[M+H]+,30.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456514,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1,342.106,[M+H]+,20.0,val,CN(Cc1ccccc1C(F)(F)F)C(=O)Cn1cc(C(=O)O)cn1
456515,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456516,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456517,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,30.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456518,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456519,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,15.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456520,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456521,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,60.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456522,O=C(Nc1cnc(C(F)(F)F)cc1)c1coc(C2CCOCC2)n1,342.106,[M+H]+,20.0,val,O=C(Nc1ccc(C(F)(F)F)nc1)c1coc(C2CCOCC2)n1
456523,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,342.106,[M+H]+,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456524,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,342.106,[M+H]+,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456525,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,342.106,[M+H]+,60.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456526,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,342.106,[M+H]+,30.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456527,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1,342.106,[M+H]+,20.0,val,O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCOC(C(F)(F)F)C1
456528,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456529,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456530,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,60.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456531,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,30.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456532,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456533,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,60.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456534,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,30.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456535,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,290.08341,[M-H]-,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456536,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,292.09796,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456537,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,292.09796,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456538,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,292.09796,[M+H]+,60.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456539,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,292.09796,[M+H]+,30.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456540,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c1cccc2F,292.09796,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC[C@H]2C(=O)O)oc2c(F)cccc12
456541,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456542,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456543,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,60.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456544,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,30.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456545,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456546,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,30.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456547,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,30.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456548,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,20.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456549,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,60.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456550,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,269.09317,[M-H]-,30.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456551,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456552,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456553,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,60.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456554,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,30.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456555,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccnc1
456556,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456557,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456558,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,30.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456559,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,60.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456560,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456561,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,45.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456562,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,60.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456563,O=C(NC(Cc1ccccc1)C(=O)O)c1cnccc1,271.10772,[M+H]+,20.0,val,O=C(NC(Cc1ccccc1)C(=O)O)c1cccnc1
456564,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456565,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456566,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456567,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,30.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456568,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456569,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,30.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456570,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456571,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,333.03731,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456572,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456573,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456574,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,60.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456575,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,30.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456576,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456577,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,45.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456578,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,60.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456579,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,333.03731,[M-H]-,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456580,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,335.05186,[M+H]+,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456581,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,335.05186,[M+H]+,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456582,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,335.05186,[M+H]+,60.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456583,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,335.05186,[M+H]+,30.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456584,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C,335.05186,[M+H]+,20.0,val,Cc1sc2nc(CS(=O)(=O)c3ccccc3)[nH]c(=O)c2c1C
456585,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1,335.05186,[M+H]+,20.0,val,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
456586,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1,335.05186,[M+H]+,20.0,val,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
456587,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1,335.05186,[M+H]+,60.0,val,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
456588,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1,335.05186,[M+H]+,15.0,val,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
456589,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1,335.05186,[M+H]+,20.0,val,CCOc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
456590,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456591,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456592,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456593,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456594,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456595,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456596,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456597,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12,335.05186,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2nccs2)c2ccccc12
456598,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456599,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456600,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,60.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456601,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,15.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456602,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456603,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,60.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456604,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,15.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456605,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,317.07791,[M-H]-,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456606,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,319.09246,[M+H]+,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456607,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,319.09246,[M+H]+,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456608,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,319.09246,[M+H]+,60.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456609,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,319.09246,[M+H]+,30.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456610,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O,319.09246,[M+H]+,20.0,val,O=C(O)COc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
456611,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,20.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456612,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,20.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456613,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,60.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456614,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,30.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456615,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,20.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456616,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,60.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456617,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,30.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456618,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1,283.11895,[M+H]+,20.0,val,COc1ccccc1-c1noc(-c2cnc(C)nc2C)n1
456619,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456620,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456621,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,60.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456622,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,30.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456623,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456624,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,60.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456625,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,30.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456626,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,281.1044,[M-H]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456627,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,317.08108,[M+Cl]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456628,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,317.08108,[M+Cl]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456629,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,317.08108,[M+Cl]-,60.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456630,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,317.08108,[M+Cl]-,15.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456631,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,317.08108,[M+Cl]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456632,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,327.10988,[M+FA]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456633,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,327.10988,[M+FA]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456634,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,327.10988,[M+FA]-,60.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456635,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,327.10988,[M+FA]-,15.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456636,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,327.10988,[M+FA]-,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456637,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,283.11895,[M+H]+,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456638,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,283.11895,[M+H]+,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456639,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,283.11895,[M+H]+,60.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456640,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,283.11895,[M+H]+,30.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456641,C/C(=C1/C(=O)Nc2c1cc(NC(N)=O)cc2)c1ccc[nH]1,283.11895,[M+H]+,20.0,val,C/C(=C1/C(=O)Nc2ccc(NC(N)=O)cc21)c1ccc[nH]1
456642,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,281.1044,[M-H]-,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456643,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,281.1044,[M-H]-,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456644,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,281.1044,[M-H]-,45.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456645,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,281.1044,[M-H]-,60.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456646,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,281.1044,[M-H]-,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456647,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456648,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456649,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,30.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456650,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,60.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456651,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,15.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456652,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456653,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,60.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456654,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12,283.11895,[M+H]+,20.0,val,O=C(NCCn1ccnc1)c1c[nH]c(=O)c2ccccc12
456655,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,20.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456656,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,20.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456657,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,45.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456658,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,60.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456659,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,20.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456660,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,45.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456661,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,60.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456662,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1,283.11895,[M+H]+,20.0,val,Cc1cccc(Cn2nc(C)c3c([N+](=O)[O-])cccc32)n1
456663,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456664,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456665,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,15.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456666,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,60.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456667,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456668,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,45.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456669,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,60.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456670,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,297.09931,[M-H]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456671,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,333.07599,[M+Cl]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456672,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,333.07599,[M+Cl]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456673,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,333.07599,[M+Cl]-,15.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456674,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,333.07599,[M+Cl]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456675,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456676,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456677,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,60.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456678,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,15.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456679,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456680,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,60.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456681,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,15.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456682,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,343.10479,[M+FA]-,20.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456683,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,299.11387,[M+H]+,30.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456684,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,299.11387,[M+H]+,30.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456685,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,299.11387,[M+H]+,60.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456686,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,299.11387,[M+H]+,15.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456687,NC(=O)c1nc(C(=O)NC(C(N)=O)c2ccccc2)ccc1,299.11387,[M+H]+,30.0,val,NC(=O)c1cccc(C(=O)NC(C(N)=O)c2ccccc2)n1
456688,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456689,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456690,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,60.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456691,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,30.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456692,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456693,COc1cc(O)c(C(=O)c2ccc(C)cc2)cc1,243.10157,[M+H]+,20.0,val,COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
456694,COc1cc(O)c(C(=O)c2ccc(C)cc2)cc1,243.10157,[M+H]+,20.0,val,COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
456695,COc1cc(O)c(C(=O)c2ccc(C)cc2)cc1,243.10157,[M+H]+,60.0,val,COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
456696,COc1cc(O)c(C(=O)c2ccc(C)cc2)cc1,243.10157,[M+H]+,30.0,val,COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
456697,COc1cc(O)c(C(=O)c2ccc(C)cc2)cc1,243.10157,[M+H]+,20.0,val,COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
456698,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456699,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456700,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,241.08702,[M-H]-,60.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456701,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456702,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,241.08702,[M-H]-,45.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456703,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,287.0925,[M+FA]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456704,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,287.0925,[M+FA]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456705,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,287.0925,[M+FA]-,60.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456706,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,287.0925,[M+FA]-,15.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456707,COc1cc(/C=C/c2cc(O)ccc2)cc(O)c1,287.0925,[M+FA]-,20.0,val,COc1cc(O)cc(/C=C/c2cccc(O)c2)c1
456708,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,20.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456709,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,20.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456710,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,60.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456711,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,30.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456712,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,20.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456713,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,60.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456714,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,30.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456715,COc1cc2c(c(O)c1)-c1c(cc(O)cc1)CC2,260.12812,[M+NH4]+,20.0,val,COc1cc(O)c2c(c1)CCc1cc(O)ccc1-2
456716,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
456717,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
456718,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1,241.08702,[M-H]-,45.0,val,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
456719,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1,241.08702,[M-H]-,60.0,val,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
456720,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1,241.08702,[M-H]-,20.0,val,COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
456721,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456722,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456723,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,45.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456724,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,60.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456725,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456726,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,20.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456727,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,45.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456728,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O,241.08702,[M-H]-,60.0,val,CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O
456729,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,409.95091,[M-H]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456730,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,409.95091,[M-H]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456731,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,409.95091,[M-H]-,60.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456732,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,409.95091,[M-H]-,15.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456733,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,409.95091,[M-H]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456734,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,445.92759,[M+Cl]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456735,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,445.92759,[M+Cl]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456736,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,445.92759,[M+Cl]-,60.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456737,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,445.92759,[M+Cl]-,15.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456738,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,445.92759,[M+Cl]-,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456739,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,411.96546,[M+H]+,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456740,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,411.96546,[M+H]+,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456741,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,411.96546,[M+H]+,60.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456742,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,411.96546,[M+H]+,30.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456743,CC(C)c1cc(Br)c(NC(=O)Nc2cnccc2)c(Br)c1,411.96546,[M+H]+,20.0,val,CC(C)c1cc(Br)c(NC(=O)Nc2cccnc2)c(Br)c1
456744,Cc1nn(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)c(C)c1,359.06143,[M+H]+,20.0,val,Cc1cc(C)n(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)n1
456745,Cc1nn(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)c(C)c1,359.06143,[M+H]+,20.0,val,Cc1cc(C)n(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)n1
456746,Cc1nn(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)c(C)c1,359.06143,[M+H]+,60.0,val,Cc1cc(C)n(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)n1
456747,Cc1nn(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)c(C)c1,359.06143,[M+H]+,15.0,val,Cc1cc(C)n(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)n1
456748,Cc1nn(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)c(C)c1,359.06143,[M+H]+,20.0,val,Cc1cc(C)n(-c2nnc(C)n2/N=C/c2ccc(Br)cc2)n1
456749,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456750,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456751,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,60.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456752,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,30.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456753,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456754,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,60.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456755,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,30.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456756,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,417.98591,[M-H]-,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456757,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456758,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456759,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,60.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456760,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,30.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456761,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456762,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,60.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456763,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,30.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456764,CCCNC(=O)NS(=O)(=O)c1c(Sc2cc(Cl)c(Cl)cc2)ccnc1,420.00046,[M+H]+,20.0,val,CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1
456765,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,20.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456766,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,20.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456767,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,60.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456768,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,30.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456769,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,20.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456770,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,30.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456771,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,20.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456772,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1,326.03562,[M-H]-,60.0,val,O=C(O)C1C2CCC(C2)C1C(=O)Nc1ccc(Cl)c(Cl)c1
456773,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,20.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456774,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,20.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456775,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,60.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456776,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,30.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456777,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,20.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456778,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,20.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456779,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,30.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456780,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1,328.05017,[M+H]+,60.0,val,CC(C)NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)o1
456781,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,339.08297,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456782,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,339.08297,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456783,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,339.08297,[M-H]-,60.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456784,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,339.08297,[M-H]-,30.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456785,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,339.08297,[M-H]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456786,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,385.08845,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456787,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,385.08845,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456788,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,385.08845,[M+FA]-,60.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456789,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,385.08845,[M+FA]-,15.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456790,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,385.08845,[M+FA]-,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456791,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,341.09752,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456792,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,341.09752,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456793,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,341.09752,[M+H]+,60.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456794,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,341.09752,[M+H]+,15.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456795,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F,341.09752,[M+H]+,20.0,val,Cn1ncc(NC(=O)N2CC(c3ccc(Cl)cc3)C2)c1C(F)F
456796,CCOC(=O)C(C)Oc1c(Cl)cc(F)c(-n2c(=O)cnn(C)c2=O)c1,389.10225,[M+NH4]+,20.0,val,CCOC(=O)C(C)Oc1cc(-n2c(=O)cnn(C)c2=O)c(F)cc1Cl
456797,CCOC(=O)C(C)Oc1c(Cl)cc(F)c(-n2c(=O)cnn(C)c2=O)c1,389.10225,[M+NH4]+,20.0,val,CCOC(=O)C(C)Oc1cc(-n2c(=O)cnn(C)c2=O)c(F)cc1Cl
456798,CCOC(=O)C(C)Oc1c(Cl)cc(F)c(-n2c(=O)cnn(C)c2=O)c1,389.10225,[M+NH4]+,60.0,val,CCOC(=O)C(C)Oc1cc(-n2c(=O)cnn(C)c2=O)c(F)cc1Cl
456799,CCOC(=O)C(C)Oc1c(Cl)cc(F)c(-n2c(=O)cnn(C)c2=O)c1,389.10225,[M+NH4]+,15.0,val,CCOC(=O)C(C)Oc1cc(-n2c(=O)cnn(C)c2=O)c(F)cc1Cl
456800,CCOC(=O)C(C)Oc1c(Cl)cc(F)c(-n2c(=O)cnn(C)c2=O)c1,389.10225,[M+NH4]+,20.0,val,CCOC(=O)C(C)Oc1cc(-n2c(=O)cnn(C)c2=O)c(F)cc1Cl
456801,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,310.06517,[M-H]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456802,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,310.06517,[M-H]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456803,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,310.06517,[M-H]-,60.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456804,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,310.06517,[M-H]-,15.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456805,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,310.06517,[M-H]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456806,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,346.04185,[M+Cl]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456807,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,356.07065,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456808,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,356.07065,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456809,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,356.07065,[M+FA]-,60.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456810,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,356.07065,[M+FA]-,15.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456811,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,356.07065,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456812,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,312.07972,[M+H]+,20.0,val,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456813,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,312.07972,[M+H]+,20.0,val,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456814,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,312.07972,[M+H]+,60.0,val,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456815,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,312.07972,[M+H]+,30.0,val,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456816,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,312.07972,[M+H]+,20.0,val,COC(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456817,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456818,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456819,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,294.06916,[M+H-H2O]+,30.0,val,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456820,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,294.06916,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456821,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)Cc1c(F)cccc1Cl)c1ccco1
456822,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456823,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456824,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,294.06916,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456825,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,294.06916,[M+H-H2O]+,30.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456826,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1,294.06916,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1c(F)cccc1Cl)Cc1ccco1
456827,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,321.06476,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456828,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,321.06476,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456829,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,321.06476,[M-H]-,60.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456830,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,321.06476,[M-H]-,30.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456831,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,321.06476,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456832,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,321.06476,[M-H]-,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456833,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,321.06476,[M-H]-,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456834,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,321.06476,[M-H]-,60.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456835,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,321.06476,[M-H]-,15.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456836,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,321.06476,[M-H]-,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456837,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,323.07931,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456838,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,323.07931,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456839,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,323.07931,[M+H]+,60.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456840,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,323.07931,[M+H]+,30.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456841,Cc1cc(C(=O)Nc2cc(Cl)c(OCC(=O)O)cc2)c(C)[nH]1,323.07931,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)c(C)[nH]1
456842,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,323.07931,[M+H]+,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456843,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,323.07931,[M+H]+,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456844,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,323.07931,[M+H]+,60.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456845,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,323.07931,[M+H]+,15.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456846,CCC(NC(=O)c1c(C)ocn1)(C(=O)O)c1ccc(Cl)cc1,323.07931,[M+H]+,20.0,val,CCC(NC(=O)c1ncoc1C)(C(=O)O)c1ccc(Cl)cc1
456847,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC,323.07931,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC
456848,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC,323.07931,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC
456849,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC,323.07931,[M+H]+,60.0,val,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC
456850,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC,323.07931,[M+H]+,30.0,val,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC
456851,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC,323.07931,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cccc(Cl)n2)cc(OC)c1OC
456852,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456853,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456854,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,60.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456855,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,15.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456856,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456857,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,15.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456858,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456859,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,333.05823,[M-H]-,60.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456860,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1,335.07279,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1
456861,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1,335.07279,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1
456862,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1,335.07279,[M+H]+,60.0,val,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1
456863,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1,335.07279,[M+H]+,30.0,val,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1
456864,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1,335.07279,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(=S)Nc2nc(C)cc(C)n2)c(Cl)c1
456865,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,316.0544,[M-H2O]+,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456866,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,316.0544,[M-H2O]+,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456867,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,316.0544,[M-H2O]+,60.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456868,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,316.0544,[M-H2O]+,30.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456869,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,316.0544,[M-H2O]+,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456870,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,335.07279,[M+H]+,15.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456871,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,335.07279,[M+H]+,15.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456872,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,335.07279,[M+H]+,60.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456873,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,335.07279,[M+H]+,20.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456874,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1,335.07279,[M+H]+,15.0,val,Cc1ccc(NC(=S)NNC(=O)Nc2ccc(Cl)cc2)cc1
456875,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456876,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456877,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,60.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456878,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,30.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456879,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456880,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,60.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456881,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,30.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456882,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,310.08964,[M-H]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456883,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,346.06632,[M+Cl]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456884,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,346.06632,[M+Cl]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456885,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,346.06632,[M+Cl]-,60.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456886,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,346.06632,[M+Cl]-,15.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456887,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,346.06632,[M+Cl]-,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456888,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,312.10419,[M+H]+,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456889,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,312.10419,[M+H]+,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456890,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,312.10419,[M+H]+,60.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456891,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,312.10419,[M+H]+,15.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456892,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1,312.10419,[M+H]+,20.0,val,O=C(O)c1cccc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1
456893,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456894,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456895,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,60.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456896,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456897,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,45.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456898,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,60.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456899,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456900,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,327.0962,[M-H]-,45.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456901,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,363.07288,[M+Cl]-,15.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456902,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,363.07288,[M+Cl]-,15.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456903,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,363.07288,[M+Cl]-,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456904,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,363.07288,[M+Cl]-,60.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456905,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,363.07288,[M+Cl]-,15.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456906,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,329.11075,[M+H]+,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456907,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,329.11075,[M+H]+,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456908,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,329.11075,[M+H]+,60.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456909,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,329.11075,[M+H]+,15.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456910,O=C(c1c(C(F)(F)F)ccc(O)c1)N1CCN(C2CC2)C(=O)C1,329.11075,[M+H]+,20.0,val,O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(C2CC2)C(=O)C1
456911,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456912,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456913,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456914,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456915,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456916,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456917,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456918,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,327.0962,[M-H]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456919,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456920,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456921,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,30.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456922,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456923,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456924,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456925,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456926,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,363.07288,[M+Cl]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456927,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456928,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456929,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456930,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456931,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456932,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456933,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456934,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,373.10168,[M+FA]-,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456935,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,327.0962,[M-H]-,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456936,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,327.0962,[M-H]-,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456937,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,327.0962,[M-H]-,60.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456938,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,327.0962,[M-H]-,15.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456939,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,327.0962,[M-H]-,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456940,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,311.10019,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456941,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,311.10019,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456942,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,311.10019,[M+H-H2O]+,60.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456943,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,311.10019,[M+H-H2O]+,15.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456944,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1,311.10019,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)Nc1ccc(C(F)(F)F)cc1
456945,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,329.11075,[M+H]+,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456946,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,329.11075,[M+H]+,60.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456947,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,329.11075,[M+H]+,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456948,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1,329.11075,[M+H]+,20.0,val,COC(CNC(=O)Nc1ccccc1C(F)(F)F)c1ccco1
456949,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456950,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456951,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,60.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456952,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,15.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456953,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456954,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,60.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456955,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,15.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456956,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,371.0795,[M-H]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456957,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,407.05618,[M+Cl]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456958,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,407.05618,[M+Cl]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456959,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,407.05618,[M+Cl]-,60.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456960,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,407.05618,[M+Cl]-,15.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456961,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,407.05618,[M+Cl]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456962,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,417.08498,[M+FA]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456963,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,417.08498,[M+FA]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456964,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,417.08498,[M+FA]-,60.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456965,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,417.08498,[M+FA]-,15.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456966,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,417.08498,[M+FA]-,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456967,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,373.09406,[M+H]+,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456968,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,373.09406,[M+H]+,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456969,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,373.09406,[M+H]+,60.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456970,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,373.09406,[M+H]+,30.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456971,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F,373.09406,[M+H]+,20.0,val,CC(NC(=O)Nc1csnc1-c1ccccc1)C(=O)NCC(F)(F)F
456972,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456973,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456974,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,60.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456975,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456976,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,45.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456977,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,60.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456978,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,20.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456979,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1,259.12412,[M+H]+,45.0,val,Cc1cc(C(=O)NCC2CC2)c2ccc(F)cc2n1
456980,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456981,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456982,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,60.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456983,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456984,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,45.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456985,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,60.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456986,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456987,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,305.07655,[M-H]-,45.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456988,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,20.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456989,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,20.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456990,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,60.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456991,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,30.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456992,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,20.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456993,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,60.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456994,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,30.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456995,O=S(=O)(c1cnccc1)N(Cc1ccc(F)cc1)C1CC1,307.0911,[M+H]+,20.0,val,O=S(=O)(c1cccnc1)N(Cc1ccc(F)cc1)C1CC1
456996,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456997,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456998,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,60.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
456999,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,30.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
457000,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
457001,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,60.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
457002,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,30.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
457003,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1,307.0911,[M+H]+,20.0,val,CC1OCCC1C(=O)Nc1ncc(-c2ccc(F)cc2)s1
457004,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457005,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457006,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,60.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457007,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,30.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457008,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457009,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457010,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,30.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457011,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,305.07655,[M-H]-,60.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457012,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,341.05323,[M+Cl]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457013,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,341.05323,[M+Cl]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457014,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,341.05323,[M+Cl]-,15.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457015,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,351.08203,[M+FA]-,15.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457016,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,351.08203,[M+FA]-,15.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457017,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,351.08203,[M+FA]-,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457018,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,351.08203,[M+FA]-,60.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457019,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,351.08203,[M+FA]-,15.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457020,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457021,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457022,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,60.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457023,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,30.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457024,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457025,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,60.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457026,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,30.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457027,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1,307.0911,[M+H]+,20.0,val,O=C(NCCCNC(=O)c1ccccc1F)c1cccs1
457028,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457029,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457030,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457031,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457032,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457033,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457034,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457035,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,273.08672,[M-H]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457036,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457037,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457038,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457039,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457040,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457041,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457042,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457043,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,309.0634,[M+Cl]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457044,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,319.0922,[M+FA]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457045,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,319.0922,[M+FA]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457046,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,319.0922,[M+FA]-,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457047,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,319.0922,[M+FA]-,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457048,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,319.0922,[M+FA]-,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457049,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457050,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457051,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,15.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457052,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457053,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,30.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457054,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457055,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,60.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457056,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1,275.10127,[M+H]+,20.0,val,CC(NC(=S)Nc1ccc(F)cc1)c1ccccc1
457057,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,270.12753,[M]+,45.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457058,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,270.12753,[M]+,45.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457059,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,270.12753,[M]+,60.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457060,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,270.12753,[M]+,20.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457061,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,270.12753,[M]+,45.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457062,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,20.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457063,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,20.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457064,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,60.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457065,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,20.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457066,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,45.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457067,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,60.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457068,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,20.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457069,Cc1cc(CNc2cc3c(C)[nH]nc3nc2)c(F)cc1,271.13535,[M+H]+,45.0,val,Cc1ccc(F)c(CNc2cnc3n[nH]c(C)c3c2)c1
457070,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457071,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457072,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,60.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457073,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457074,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,45.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457075,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457076,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457077,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,45.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457078,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,60.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457079,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457080,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,45.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457081,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,60.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457082,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,328.06961,[M-H]-,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457083,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457084,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457085,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,30.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457086,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,60.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457087,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457088,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,45.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457089,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457090,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,328.06961,[M-H]-,60.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457091,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457092,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457093,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,60.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457094,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,30.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457095,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457096,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,60.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457097,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,30.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457098,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12,330.08416,[M+H]+,20.0,val,CCNC(=S)NNc1ncnc2scc(-c3ccccc3)c12
457099,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457100,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457101,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,60.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457102,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,30.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457103,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457104,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,60.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457105,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,30.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457106,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12,330.08416,[M+H]+,20.0,val,CCCSCc1nnc2sc(-c3cc4ccccc4[nH]3)nn12
457107,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457108,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457109,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,60.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457110,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,30.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457111,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457112,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,45.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457113,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,60.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457114,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1,330.08416,[M+H]+,20.0,val,CSc1nc(C)cc(-n2cnc(SCc3ccccc3)n2)n1
457115,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1,322.07437,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1
457116,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1,322.07437,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1
457117,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1,322.07437,[M+H]+,60.0,val,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1
457118,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1,322.07437,[M+H]+,30.0,val,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1
457119,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1,322.07437,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)c1ccc(OC)c(OC)c1
457120,CCOC(=O)COc1c(OC)cc(/C=C2/SC(=S)NC2=O)cc1,352.03189,[M-H]-,20.0,val,CCOC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1OC
457121,CCOC(=O)COc1c(OC)cc(/C=C2/SC(=S)NC2=O)cc1,352.03189,[M-H]-,20.0,val,CCOC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1OC
457122,CCOC(=O)COc1c(OC)cc(/C=C2/SC(=S)NC2=O)cc1,352.03189,[M-H]-,60.0,val,CCOC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1OC
457123,CCOC(=O)COc1c(OC)cc(/C=C2/SC(=S)NC2=O)cc1,352.03189,[M-H]-,15.0,val,CCOC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1OC
457124,CCOC(=O)COc1c(OC)cc(/C=C2/SC(=S)NC2=O)cc1,352.03189,[M-H]-,20.0,val,CCOC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1OC
457125,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,336.0579,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457126,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,336.0579,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457127,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,336.0579,[M-H]-,60.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457128,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,336.0579,[M-H]-,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457129,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,336.0579,[M-H]-,45.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457130,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457131,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457132,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,60.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457133,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457134,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,45.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457135,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,60.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457136,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,20.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457137,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cc(Cl)ccc1,338.07245,[M+H]+,45.0,val,O=S(=O)(NC1CCN(c2ccccn2)C1)c1cccc(Cl)c1
457138,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457139,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457140,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,60.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457141,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,30.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457142,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457143,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457144,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,30.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457145,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,336.0579,[M-H]-,60.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457146,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,372.03458,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457147,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,372.03458,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457148,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,372.03458,[M+Cl]-,60.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457149,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,372.03458,[M+Cl]-,15.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457150,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,372.03458,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457151,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,338.07245,[M+H]+,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457152,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,338.07245,[M+H]+,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457153,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,338.07245,[M+H]+,60.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457154,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,338.07245,[M+H]+,30.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457155,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl,338.07245,[M+H]+,20.0,val,COc1cc(NC(=S)NCc2cccnc2)c(OC)cc1Cl
457156,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1,338.07245,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1
457157,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1,338.07245,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1
457158,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1,338.07245,[M+H]+,60.0,val,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1
457159,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1,338.07245,[M+H]+,15.0,val,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1
457160,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1,338.07245,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCC(Oc2ncc(Cl)cn2)C1
457161,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457162,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457163,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,60.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457164,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,30.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457165,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457166,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,30.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457167,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,60.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457168,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1,338.07245,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(c2ncc(Cl)cn2)CC1
457169,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457170,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457171,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,60.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457172,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457173,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,45.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457174,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,60.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457175,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457176,Cc1c(NC(=O)c2c3CS(=O)(=O)CCc3nn2C)cc(Cl)cc1,352.05281,[M-H]-,45.0,val,Cc1ccc(Cl)cc1NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2
457177,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457178,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457179,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,60.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457180,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,30.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457181,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457182,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,30.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457183,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457184,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,340.02382,[M-H]-,60.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457185,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,386.0293,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457186,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,386.0293,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457187,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,386.0293,[M+FA]-,60.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457188,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,386.0293,[M+FA]-,15.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457189,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1,386.0293,[M+FA]-,20.0,val,O=C(NCC1(c2ccsc2)CCOCC1)c1ccc(Cl)s1
457190,O=C(CC1CC(c2c(F)cc(F)cc2)=NO1)N1CCOCC1,311.12018,[M+H]+,20.0,val,O=C(CC1CC(c2ccc(F)cc2F)=NO1)N1CCOCC1
457191,O=C(CC1CC(c2c(F)cc(F)cc2)=NO1)N1CCOCC1,311.12018,[M+H]+,20.0,val,O=C(CC1CC(c2ccc(F)cc2F)=NO1)N1CCOCC1
457192,O=C(CC1CC(c2c(F)cc(F)cc2)=NO1)N1CCOCC1,311.12018,[M+H]+,60.0,val,O=C(CC1CC(c2ccc(F)cc2F)=NO1)N1CCOCC1
457193,O=C(CC1CC(c2c(F)cc(F)cc2)=NO1)N1CCOCC1,311.12018,[M+H]+,30.0,val,O=C(CC1CC(c2ccc(F)cc2F)=NO1)N1CCOCC1
457194,O=C(CC1CC(c2c(F)cc(F)cc2)=NO1)N1CCOCC1,311.12018,[M+H]+,20.0,val,O=C(CC1CC(c2ccc(F)cc2F)=NO1)N1CCOCC1
457195,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457196,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457197,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457198,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,30.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457199,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457200,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457201,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457202,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457203,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,15.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457204,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457205,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,45.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457206,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457207,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457208,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,333.10212,[M+Na]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457209,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,333.10212,[M+Na]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457210,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,333.10212,[M+Na]+,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457211,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,333.10212,[M+Na]+,30.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457212,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,333.10212,[M+Na]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457213,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457214,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457215,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457216,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,30.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457217,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457218,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,30.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457219,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457220,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,309.10562,[M-H]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457221,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,345.0823,[M+Cl]-,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457222,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457223,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457224,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457225,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457226,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,20.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457227,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F,311.12018,[M+H]+,60.0,val,CCCNc1c(F)cc2c(=O)c(C(=O)O)cn(CC)c2c1F
457228,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1,356.11513,[M+H]+,20.0,val,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1
457229,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1,356.11513,[M+H]+,20.0,val,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1
457230,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1,356.11513,[M+H]+,45.0,val,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1
457231,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1,356.11513,[M+H]+,60.0,val,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1
457232,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1,356.11513,[M+H]+,20.0,val,Cc1nnc(N2CCC3CN(c4ccc(C(F)(F)F)cn4)CC32)s1
457233,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,20.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457234,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,20.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457235,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,60.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457236,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,30.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457237,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,20.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457238,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,60.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457239,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,30.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457240,COc1c(F)cc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1,320.10521,[M-H]-,20.0,val,COc1ccc(C(C)NC(=O)c2c(C(=O)O)cnn2C)cc1F
457241,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1,319.05804,[M-H]-,20.0,val,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1
457242,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1,319.05804,[M-H]-,20.0,val,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1
457243,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1,319.05804,[M-H]-,60.0,val,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1
457244,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1,319.05804,[M-H]-,30.0,val,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1
457245,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1,319.05804,[M-H]-,20.0,val,O=C(Nc1onc2c1CSC2)C1(c2cccs2)CCCC1
457246,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457247,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457248,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,60.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457249,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,30.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457250,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457251,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457252,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,30.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457253,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,319.05804,[M-H]-,60.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457254,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,20.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457255,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,20.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457256,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,60.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457257,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,30.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457258,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,20.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457259,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,60.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457260,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,20.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457261,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1,321.0726,[M+H]+,30.0,val,COc1ccccc1C1SC(C)C(=O)N1c1ncc(C)s1
457262,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O,321.0726,[M+H]+,20.0,val,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O
457263,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O,321.0726,[M+H]+,20.0,val,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O
457264,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O,321.0726,[M+H]+,60.0,val,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O
457265,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O,321.0726,[M+H]+,30.0,val,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O
457266,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O,321.0726,[M+H]+,20.0,val,Cc1ccccc1C1CC(c2cccs2)=NN1S(C)(=O)=O
457267,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,20.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457268,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,20.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457269,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,60.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457270,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,30.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457271,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,20.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457272,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,60.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457273,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,20.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457274,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1,321.0726,[M+H]+,30.0,val,CC1CN(C(=O)c2cccs2)CCN1C(=O)c1cccs1
457275,O=C(NCc1cccs1)c1cccnc1OC1CCSC1,321.0726,[M+H]+,15.0,val,O=C(NCc1cccs1)c1cccnc1OC1CCSC1
457276,O=C(NCc1cccs1)c1cccnc1OC1CCSC1,321.0726,[M+H]+,15.0,val,O=C(NCc1cccs1)c1cccnc1OC1CCSC1
457277,O=C(NCc1cccs1)c1cccnc1OC1CCSC1,321.0726,[M+H]+,60.0,val,O=C(NCc1cccs1)c1cccnc1OC1CCSC1
457278,O=C(NCc1cccs1)c1cccnc1OC1CCSC1,321.0726,[M+H]+,20.0,val,O=C(NCc1cccs1)c1cccnc1OC1CCSC1
457279,O=C(NCc1cccs1)c1cccnc1OC1CCSC1,321.0726,[M+H]+,15.0,val,O=C(NCc1cccs1)c1cccnc1OC1CCSC1
457280,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,321.0726,[M+H]+,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457281,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,321.0726,[M+H]+,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457282,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,321.0726,[M+H]+,60.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457283,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,321.0726,[M+H]+,15.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457284,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1,321.0726,[M+H]+,20.0,val,O=C(NC(=S)N(CCO)Cc1ccccc1)c1cccs1
457285,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,20.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457286,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,20.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457287,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,60.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457288,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,30.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457289,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,20.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457290,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,60.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457291,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,30.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457292,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1,321.0726,[M+H]+,20.0,val,O=C(CSc1nc(-c2ccccc2)cs1)N1CCOCC1
457293,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,351.04787,[M-H]-,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457294,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,351.04787,[M-H]-,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457295,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,351.04787,[M-H]-,60.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457296,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,351.04787,[M-H]-,15.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457297,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,351.04787,[M-H]-,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457298,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457299,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457300,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,60.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457301,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,30.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457302,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457303,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,60.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457304,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,30.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457305,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1,353.06242,[M+H]+,20.0,val,O=C(O)c1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cs1
457306,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,45.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457307,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,45.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457308,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,45.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457309,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457310,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457311,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457312,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,45.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457313,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,351.04787,[M-H]-,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457314,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457315,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457316,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457317,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457318,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457319,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,30.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457320,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,20.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457321,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1,353.06242,[M+H]+,60.0,val,CCOC(=O)NS(=O)(=O)c1cnccc1Sc1cccc(C)c1
457322,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457323,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457324,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,60.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457325,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,30.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457326,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457327,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,60.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457328,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,30.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457329,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,303.09865,[M-H]-,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457330,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,303.09865,[M-H]-,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457331,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,303.09865,[M-H]-,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457332,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,303.09865,[M-H]-,60.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457333,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,303.09865,[M-H]-,15.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457334,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,303.09865,[M-H]-,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457335,CC(C)c1noc(C(=O)N2CCc3c(cco3)C2C(=O)O)c1,303.09865,[M-H]-,20.0,val,CC(C)c1cc(C(=O)N2CCc3occc3C2C(=O)O)on1
457336,CC(C)c1noc(C(=O)N2CCc3c(cco3)C2C(=O)O)c1,303.09865,[M-H]-,20.0,val,CC(C)c1cc(C(=O)N2CCc3occc3C2C(=O)O)on1
457337,CC(C)c1noc(C(=O)N2CCc3c(cco3)C2C(=O)O)c1,303.09865,[M-H]-,60.0,val,CC(C)c1cc(C(=O)N2CCc3occc3C2C(=O)O)on1
457338,CC(C)c1noc(C(=O)N2CCc3c(cco3)C2C(=O)O)c1,303.09865,[M-H]-,15.0,val,CC(C)c1cc(C(=O)N2CCc3occc3C2C(=O)O)on1
457339,CC(C)c1noc(C(=O)N2CCc3c(cco3)C2C(=O)O)c1,303.09865,[M-H]-,20.0,val,CC(C)c1cc(C(=O)N2CCc3occc3C2C(=O)O)on1
457340,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457341,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457342,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,60.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457343,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457344,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457345,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,60.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457346,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457347,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,303.09865,[M-H]-,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457348,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,305.1132,[M+H]+,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457349,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,305.1132,[M+H]+,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457350,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,305.1132,[M+H]+,60.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457351,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,305.1132,[M+H]+,15.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457352,COc1ccc(C(NC(=O)Cc2noc(C)c2)C(=O)O)cc1,305.1132,[M+H]+,20.0,val,COc1ccc(C(NC(=O)Cc2cc(C)on2)C(=O)O)cc1
457353,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,305.1132,[M+H]+,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457354,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,305.1132,[M+H]+,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457355,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,305.1132,[M+H]+,60.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457356,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,305.1132,[M+H]+,15.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457357,COc1cccc(C(CC(=O)O)NC(=O)c2c(C)ocn2)c1,305.1132,[M+H]+,20.0,val,COc1cccc(C(CC(=O)O)NC(=O)c2ncoc2C)c1
457358,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,287.10264,[M+H-H2O]+,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457359,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,287.10264,[M+H-H2O]+,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457360,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,287.10264,[M+H-H2O]+,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457361,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,287.10264,[M+H-H2O]+,60.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457362,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,287.10264,[M+H-H2O]+,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457363,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457364,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457365,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,30.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457366,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457367,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,15.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457368,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457369,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457370,CCOc1ccc(NC(=O)CCc2c(C(=O)O)nco2)cc1,305.1132,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CCc2ocnc2C(=O)O)cc1
457371,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457372,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457373,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,60.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457374,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,15.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457375,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457376,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457377,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457378,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,60.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457379,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,15.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457380,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457381,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457382,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457383,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,303.09865,[M-H]-,60.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457384,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,303.09865,[M-H]-,15.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457385,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457386,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O
457387,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O
457388,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O,303.09865,[M-H]-,60.0,val,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O
457389,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O,303.09865,[M-H]-,30.0,val,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O
457390,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O,303.09865,[M-H]-,20.0,val,O=C(CCc1cc(=O)[nH]o1)N[C@@H](Cc1ccccc1)C(=O)O
457391,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,305.1132,[M+H]+,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457392,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,305.1132,[M+H]+,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457393,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,305.1132,[M+H]+,60.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457394,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,305.1132,[M+H]+,15.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457395,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,305.1132,[M+H]+,20.0,val,O=C(O)CCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
457396,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457397,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457398,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,60.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457399,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,30.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457400,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,303.09865,[M-H]-,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457401,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457402,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457403,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,60.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457404,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,15.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457405,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O,305.1132,[M+H]+,20.0,val,COC(=O)C1C2c3ccccc3O[C@]1(C)NC(=O)N2C(C)=O
457406,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,287.10264,[M+H-H2O]+,45.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457407,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,287.10264,[M+H-H2O]+,45.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457408,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,287.10264,[M+H-H2O]+,45.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457409,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,287.10264,[M+H-H2O]+,20.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457410,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,287.10264,[M+H-H2O]+,60.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457411,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,20.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457412,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,20.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457413,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,60.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457414,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,30.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457415,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,20.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457416,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,60.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457417,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,30.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457418,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1,305.1132,[M+H]+,20.0,val,COc1ccc(C(C)=O)c(Oc2cc(=O)n(C)c(=O)n2C)c1
457419,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,20.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457420,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,20.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457421,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,60.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457422,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,30.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457423,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,20.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457424,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,30.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457425,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,60.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457426,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C,305.1132,[M+H]+,20.0,val,COC(=O)c1cc(C)ccc1Oc1cc(=O)n(C)c(=O)n1C
457427,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,20.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457428,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,20.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457429,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,60.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457430,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,30.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457431,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,20.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457432,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,60.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457433,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,30.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457434,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1,305.07768,[M+H]+,20.0,val,CSc1ncccc1C(=O)NCC1(c2ccsc2)CC1
457435,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O
457436,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O
457437,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,60.0,val,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O
457438,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,30.0,val,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O
457439,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CSc1nc(=S)n(Cc2ccccc2)c(C)c1C(C)=O
457440,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457441,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457442,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,45.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457443,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,60.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457444,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457445,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,20.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457446,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,45.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457447,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O,305.07768,[M+H]+,60.0,val,CCSc1nc(=S)n(-c2ccccc2)c(C)c1C(C)=O
457448,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1,305.07768,[M+H]+,20.0,val,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1
457449,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1,305.07768,[M+H]+,20.0,val,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1
457450,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1,305.07768,[M+H]+,60.0,val,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1
457451,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1,305.07768,[M+H]+,15.0,val,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1
457452,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1,305.07768,[M+H]+,20.0,val,Cc1ccc(/C=N/c2sc3c(c2C(N)=O)CCCC3)s1
457453,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,20.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457454,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,20.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457455,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,60.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457456,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,15.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457457,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,20.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457458,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,60.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457459,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,20.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457460,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1,305.07768,[M+H]+,15.0,val,CCc1cc2c(cc(C(=O)NCc3cccs3)n2C)s1
457461,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1,305.07768,[M+H]+,20.0,val,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1
457462,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1,305.07768,[M+H]+,20.0,val,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1
457463,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1,305.07768,[M+H]+,60.0,val,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1
457464,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1,305.07768,[M+H]+,15.0,val,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1
457465,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1,305.07768,[M+H]+,20.0,val,O=C(c1ccccn1)N1CCSC(c2cccs2)CC1
457466,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1,305.07768,[M+H]+,20.0,val,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1
457467,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1,305.07768,[M+H]+,20.0,val,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1
457468,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1,305.07768,[M+H]+,60.0,val,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1
457469,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1,305.07768,[M+H]+,30.0,val,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1
457470,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1,305.07768,[M+H]+,20.0,val,O=C(c1ccsc1)N1CC(N2CCc3sccc3C2)C1
457471,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,20.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457472,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,20.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457473,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,60.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457474,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,20.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457475,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,60.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457476,CNc1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,270.10595,[M]+,20.0,val,CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
457477,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457478,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457479,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,60.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457480,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457481,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,45.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457482,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,60.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457483,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457484,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,299.11496,[M-H]-,45.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457485,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,345.12044,[M+FA]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457486,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,345.12044,[M+FA]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457487,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,345.12044,[M+FA]-,60.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457488,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,345.12044,[M+FA]-,15.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457489,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,345.12044,[M+FA]-,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457490,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457491,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457492,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,60.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457493,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,30.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457494,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457495,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,60.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457496,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,30.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457497,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,299.11496,[M-H]-,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457498,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,345.12044,[M+FA]-,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457499,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,345.12044,[M+FA]-,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457500,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,345.12044,[M+FA]-,60.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457501,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,345.12044,[M+FA]-,15.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457502,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,345.12044,[M+FA]-,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457503,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,265.1084,[M+H-2H2O]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457504,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,265.1084,[M+H-2H2O]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457505,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,265.1084,[M+H-2H2O]+,60.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457506,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,265.1084,[M+H-2H2O]+,30.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457507,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,265.1084,[M+H-2H2O]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457508,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457509,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457510,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,30.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457511,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,60.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457512,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,15.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457513,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457514,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,60.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457515,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1,301.12952,[M+H]+,20.0,val,CCNC(=O)C1CN(C(=O)c2nnc(-c3ccccc3)o2)C1
457516,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,301.12952,[M+H]+,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457517,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,301.12952,[M+H]+,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457518,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,301.12952,[M+H]+,60.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457519,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,301.12952,[M+H]+,30.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457520,CC(C)n1cc(NC(=O)c2cc3c(cc2)OCC(=O)N3)cn1,301.12952,[M+H]+,20.0,val,CC(C)n1cc(NC(=O)c2ccc3c(c2)NC(=O)CO3)cn1
457521,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,301.12952,[M+H]+,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457522,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,301.12952,[M+H]+,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457523,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,301.12952,[M+H]+,60.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457524,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,301.12952,[M+H]+,15.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457525,Cc1cc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)ccc1,301.12952,[M+H]+,20.0,val,Cc1cccc(-n2cc(C(=O)N3CCC(C(=O)O)C3)nn2)c1
457526,COc1c(OC)cc(Cc2nc(Cn3ccnc3)no2)cc1,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457527,COc1c(OC)cc(Cc2nc(Cn3ccnc3)no2)cc1,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457528,COc1c(OC)cc(Cc2nc(Cn3ccnc3)no2)cc1,301.12952,[M+H]+,60.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457529,COc1c(OC)cc(Cc2nc(Cn3ccnc3)no2)cc1,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457530,COc1c(OC)cc(Cc2nc(Cn3ccnc3)no2)cc1,301.12952,[M+H]+,45.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457531,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,45.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457532,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,45.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457533,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,30.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457534,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457535,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,60.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457536,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,45.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457537,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457538,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,60.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457539,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457540,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457541,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,60.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457542,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,30.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457543,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457544,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457545,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,30.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457546,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,299.11496,[M-H]-,60.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457547,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,345.12044,[M+FA]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457548,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,345.12044,[M+FA]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457549,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,345.12044,[M+FA]-,60.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457550,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,345.12044,[M+FA]-,15.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457551,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,345.12044,[M+FA]-,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457552,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457553,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457554,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,60.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457555,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,30.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457556,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457557,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457558,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,30.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457559,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1,301.12952,[M+H]+,60.0,val,Cc1cc(C)n(CCNC(=O)c2cc(-c3ccco3)on2)n1
457560,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1,301.12952,[M+H]+,20.0,val,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1
457561,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1,301.12952,[M+H]+,20.0,val,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1
457562,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1,301.12952,[M+H]+,60.0,val,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1
457563,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1,301.12952,[M+H]+,15.0,val,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1
457564,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1,301.12952,[M+H]+,20.0,val,O=C(c1ccc[nH]c1=O)N1CCC(Oc2cnccn2)CC1
457565,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,301.12952,[M+H]+,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457566,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,301.12952,[M+H]+,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457567,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,301.12952,[M+H]+,60.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457568,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,301.12952,[M+H]+,30.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457569,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1,301.12952,[M+H]+,20.0,val,COc1cccc(C(=O)NCCNC(=O)c2cnccn2)c1
457570,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,20.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457571,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,20.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457572,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,45.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457573,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,60.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457574,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,20.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457575,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,45.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457576,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,60.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457577,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1,301.12952,[M+H]+,20.0,val,O=C1OCCN1C1CCN(c2cc(=O)n3ccccc3n2)C1
457578,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,20.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457579,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,20.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457580,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,60.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457581,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,30.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457582,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,20.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457583,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,30.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457584,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,20.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457585,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1,301.12952,[M+H]+,60.0,val,CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1
457586,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,20.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457587,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,20.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457588,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,60.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457589,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,30.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457590,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,20.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457591,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,30.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457592,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,60.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457593,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C,301.12952,[M+H]+,20.0,val,Cc1cnc2c(c1NCc1ccco1)c(=O)n(C)c(=O)n2C
457594,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,20.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457595,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,20.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457596,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,60.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457597,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,30.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457598,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,20.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457599,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,30.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457600,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,20.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457601,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1,301.12952,[M+H]+,60.0,val,CN(C)c1nccc(CNC(=O)c2ccc3c(c2)OCO3)n1
457602,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457603,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457604,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,45.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457605,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,60.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457606,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457607,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,60.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457608,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,20.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457609,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC,301.12952,[M+H]+,45.0,val,COc1cccc(-c2noc(Cn3ccnc3C)n2)c1OC
457610,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,20.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457611,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,20.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457612,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,60.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457613,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,30.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457614,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,20.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457615,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,20.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457616,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,30.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457617,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1,301.12952,[M+H]+,60.0,val,COc1nc(OC)c2c(COCc3ccccc3)[nH]nc2n1
457618,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457619,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457620,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,60.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457621,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,15.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457622,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457623,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,45.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457624,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,60.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457625,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC,301.12952,[M+H]+,20.0,val,COc1ccc(Cc2nc(Cn3ccnc3)no2)cc1OC
457626,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2,301.12952,[M+H]+,20.0,val,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2
457627,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2,301.12952,[M+H]+,20.0,val,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2
457628,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2,301.12952,[M+H]+,60.0,val,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2
457629,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2,301.12952,[M+H]+,15.0,val,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2
457630,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2,301.12952,[M+H]+,20.0,val,CC(C(=O)Nc1ncccc1O)n1nc2c(cc1=O)CCC2
457631,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,20.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457632,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,20.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457633,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,60.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457634,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,45.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457635,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,60.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457636,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,331.08704,[M-H]-,45.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457637,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,333.10159,[M+H]+,20.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457638,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,333.10159,[M+H]+,20.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457639,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,333.10159,[M+H]+,60.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457640,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,333.10159,[M+H]+,30.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457641,CC(=O)N1Cc2c(cc(S(=O)(=O)Nc3cnc(C)nc3)cc2)C1,333.10159,[M+H]+,20.0,val,CC(=O)N1Cc2ccc(S(=O)(=O)Nc3cnc(C)nc3)cc2C1
457642,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457643,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457644,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,30.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457645,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457646,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457647,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,45.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457648,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457649,Cc1nnc(N2CC(NC(=O)c3c4OCCOc4ccc3)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457650,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457651,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457652,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457653,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457654,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457655,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457656,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457657,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,331.08704,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457658,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457659,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457660,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457661,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,15.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457662,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457663,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457664,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,15.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457665,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,331.08704,[M-H]-,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457666,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457667,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457668,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457669,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,15.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457670,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457671,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457672,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457673,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,367.06371,[M+Cl]-,15.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457674,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,377.09251,[M+FA]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457675,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,377.09251,[M+FA]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457676,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,377.09251,[M+FA]-,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457677,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,377.09251,[M+FA]-,15.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457678,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,377.09251,[M+FA]-,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457679,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457680,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457681,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457682,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457683,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457684,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457685,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457686,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C,333.10159,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C
457687,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457688,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457689,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,60.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457690,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,30.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457691,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457692,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,60.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457693,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,30.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457694,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C,333.10159,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2cc3c(=O)n(C)ncn3c2)cc1C
457695,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457696,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457697,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,60.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457698,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,30.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457699,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457700,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457701,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,30.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457702,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,333.10159,[M+H]+,60.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457703,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,355.08353,[M+Na]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457704,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,355.08353,[M+Na]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457705,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,355.08353,[M+Na]+,30.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457706,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O,355.08353,[M+Na]+,20.0,val,CN1c2ccccc2N(CCNC(=O)c2ccccn2)S1(=O)=O
457707,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,20.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457708,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,20.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457709,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,45.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457710,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,60.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457711,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,20.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457712,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,45.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457713,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,60.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457714,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC,333.10159,[M+H]+,20.0,val,CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC
457715,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457716,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457717,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1,333.10159,[M+H]+,45.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457718,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1,333.10159,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457719,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1,333.10159,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3cccc4c3OCCO4)C2)s1
457720,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457721,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457722,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457723,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,30.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457724,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457725,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,30.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457726,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,60.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457727,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1,333.10159,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)Nc2c3c(nn2C)CSC3)cc1
457728,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,315.10988,[M-H]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457729,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,315.10988,[M-H]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457730,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,315.10988,[M-H]-,45.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457731,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,315.10988,[M-H]-,60.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457732,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,315.10988,[M-H]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457733,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,361.11536,[M+FA]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457734,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,361.11536,[M+FA]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457735,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,361.11536,[M+FA]-,30.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457736,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,361.11536,[M+FA]-,60.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457737,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,361.11536,[M+FA]-,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457738,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457739,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457740,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,60.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457741,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,30.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457742,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457743,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457744,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,30.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457745,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,315.10988,[M-H]-,60.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457746,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,361.11536,[M+FA]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457747,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,361.11536,[M+FA]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457748,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,361.11536,[M+FA]-,60.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457749,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,361.11536,[M+FA]-,15.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457750,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,361.11536,[M+FA]-,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457751,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457752,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457753,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457754,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,30.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457755,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457756,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,30.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457757,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,60.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457758,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1,317.12443,[M+H]+,20.0,val,COc1nc(CNC(=O)c2ccc(C(C)=O)cc2)nc(OC)n1
457759,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457760,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457761,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,60.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457762,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,30.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457763,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457764,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,30.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457765,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457766,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O,317.12443,[M+H]+,60.0,val,Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1=O
457767,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,317.12443,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457768,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,317.12443,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457769,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,317.12443,[M+H]+,60.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457770,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,317.12443,[M+H]+,15.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457771,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1,317.12443,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)NCC(c1ccco1)n1cccn1
457772,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,299.09721,[M-H]-,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457773,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,299.09721,[M-H]-,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457774,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,299.09721,[M-H]-,60.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457775,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,299.09721,[M-H]-,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457776,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,299.09721,[M-H]-,45.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457777,CCN(CCO)c1c2snc(-c3ccccc3)c2ncn1,301.11176,[M+H]+,20.0,val,CCN(CCO)c1ncnc2c(-c3ccccc3)nsc12
457778,CCN(CCO)c1c2snc(-c3ccccc3)c2ncn1,301.11176,[M+H]+,20.0,val,CCN(CCO)c1ncnc2c(-c3ccccc3)nsc12
457779,CCN(CCO)c1c2snc(-c3ccccc3)c2ncn1,301.11176,[M+H]+,60.0,val,CCN(CCO)c1ncnc2c(-c3ccccc3)nsc12
457780,CCN(CCO)c1c2snc(-c3ccccc3)c2ncn1,301.11176,[M+H]+,20.0,val,CCN(CCO)c1ncnc2c(-c3ccccc3)nsc12
457781,CCN(CCO)c1c2snc(-c3ccccc3)c2ncn1,301.11176,[M+H]+,60.0,val,CCN(CCO)c1ncnc2c(-c3ccccc3)nsc12
457782,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457783,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457784,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,301.11176,[M+H]+,60.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457785,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,301.11176,[M+H]+,30.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457786,CC1CCc2c(C1)sc(NC(=O)c1nn(C)cc1)c2C#N,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457787,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457788,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457789,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,60.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457790,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457791,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,45.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457792,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,60.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457793,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457794,Cc1nc(C)c(C(=O)NCc2cc3c(cc2)n(C)cn3)s1,301.11176,[M+H]+,45.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457795,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,20.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457796,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,20.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457797,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,60.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457798,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,30.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457799,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,20.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457800,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,60.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457801,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,30.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457802,Cc1ccc(C(=O)NCCc2nc3c(nccc3)n2C)s1,301.11176,[M+H]+,20.0,val,Cc1ccc(C(=O)NCCc2nc3cccnc3n2C)s1
457803,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,299.09721,[M-H]-,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457804,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,299.09721,[M-H]-,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457805,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,299.09721,[M-H]-,60.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457806,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,299.09721,[M-H]-,15.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457807,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,299.09721,[M-H]-,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457808,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457809,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457810,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457811,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457812,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457813,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457814,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457815,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,299.09721,[M-H]-,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457816,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457817,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457818,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457819,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,15.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457820,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457821,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,15.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457822,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457823,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,335.07388,[M+Cl]-,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457824,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,345.10268,[M+FA]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457825,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,345.10268,[M+FA]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457826,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,345.10268,[M+FA]-,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457827,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,345.10268,[M+FA]-,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457828,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,345.10268,[M+FA]-,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457829,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,299.09721,[M-H]-,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457830,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,299.09721,[M-H]-,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457831,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,299.09721,[M-H]-,60.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457832,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,299.09721,[M-H]-,30.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457833,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,299.09721,[M-H]-,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457834,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,20.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457835,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,20.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457836,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,60.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457837,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,30.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457838,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,20.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457839,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,60.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457840,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,30.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457841,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12,301.11176,[M+H]+,20.0,val,Cc1ccsc1C(=O)Nc1cccn2nc(C(C)C)nc12
457842,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,20.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457843,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,20.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457844,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,60.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457845,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,30.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457846,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,20.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457847,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,45.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457848,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,20.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457849,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,60.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457850,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1,301.11176,[M+H]+,45.0,val,CCOc1ccc(-c2ccc3nnc(SCC)n3n2)cc1
457851,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457852,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457853,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,45.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457854,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,60.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457855,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457856,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,60.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457857,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,45.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457858,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1,301.11176,[M+H]+,20.0,val,Cc1nc(C)c(C(=O)NCc2ccc3c(c2)ncn3C)s1
457859,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,301.11176,[M+H]+,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457860,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,301.11176,[M+H]+,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457861,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,301.11176,[M+H]+,60.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457862,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,301.11176,[M+H]+,30.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457863,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1,301.11176,[M+H]+,20.0,val,CCCc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1
457864,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457865,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457866,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,60.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457867,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,30.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457868,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457869,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,30.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457870,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,20.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457871,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1,301.11176,[M+H]+,60.0,val,Cc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)n1
457872,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1,301.11176,[M+H]+,20.0,val,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1
457873,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1,301.11176,[M+H]+,20.0,val,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1
457874,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1,301.11176,[M+H]+,60.0,val,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1
457875,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1,301.11176,[M+H]+,30.0,val,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1
457876,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1,301.11176,[M+H]+,20.0,val,O=C(Cc1csc(-n2cccc2)n1)NCCn1cccc1
457877,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457878,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457879,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,60.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457880,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,15.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457881,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457882,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,60.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457883,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,15.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457884,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21,301.11176,[M+H]+,20.0,val,CCn1cc(NC(=O)Nc2nc(C)cs2)c2ccccc21
457885,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,283.1012,[M+H-H2O]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457886,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,283.1012,[M+H-H2O]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457887,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,283.1012,[M+H-H2O]+,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457888,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,283.1012,[M+H-H2O]+,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457889,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,283.1012,[M+H-H2O]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457890,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457891,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457892,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457893,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457894,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457895,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,20.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457896,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,30.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457897,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1,301.11176,[M+H]+,60.0,val,CC(O)(CNc1ncnc2cnccc12)Cc1ccsc1
457898,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457899,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457900,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1,301.11176,[M+H]+,60.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457901,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1,301.11176,[M+H]+,30.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457902,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1,301.11176,[M+H]+,20.0,val,CC1CCc2c(sc(NC(=O)c3ccn(C)n3)c2C#N)C1
457903,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,20.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457904,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,20.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457905,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,30.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457906,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,60.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457907,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,20.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457908,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,45.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457909,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,20.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457910,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1,301.11176,[M+H]+,60.0,val,N#CCSc1nc(NCC2CCCO2)c2ccccc2n1
457911,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,20.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457912,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,20.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457913,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,60.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457914,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,20.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457915,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,60.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457916,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3,317.08891,[M+H]+,20.0,val,Cn1ccnc1Sc1ncnc2sc3c(c12)CCCCC3
457917,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,311.1262,[M-H]-,45.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457918,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,311.1262,[M-H]-,45.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457919,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,311.1262,[M-H]-,45.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457920,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,311.1262,[M-H]-,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457921,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,311.1262,[M-H]-,60.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457922,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,357.13168,[M+FA]-,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457923,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,357.13168,[M+FA]-,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457924,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,357.13168,[M+FA]-,60.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457925,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,357.13168,[M+FA]-,15.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457926,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,357.13168,[M+FA]-,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457927,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457928,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457929,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457930,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,30.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457931,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457932,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457933,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,30.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457934,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,311.1262,[M-H]-,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457935,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,347.10287,[M+Cl]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457936,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,347.10287,[M+Cl]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457937,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,347.10287,[M+Cl]-,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457938,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,347.10287,[M+Cl]-,15.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457939,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,347.10287,[M+Cl]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457940,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,357.13168,[M+FA]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457941,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,357.13168,[M+FA]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457942,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,357.13168,[M+FA]-,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457943,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,357.13168,[M+FA]-,15.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457944,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,357.13168,[M+FA]-,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
457945,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457946,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457947,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457948,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457949,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457950,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,45.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457951,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457952,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,311.1262,[M-H]-,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457953,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457954,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457955,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457956,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,30.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457957,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457958,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,30.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457959,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457960,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,311.1262,[M-H]-,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457961,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,347.10287,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457962,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,347.10287,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457963,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,347.10287,[M+Cl]-,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457964,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,347.10287,[M+Cl]-,15.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457965,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,347.10287,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457966,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,357.13168,[M+FA]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457967,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,357.13168,[M+FA]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457968,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,357.13168,[M+FA]-,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457969,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,357.13168,[M+FA]-,15.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457970,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,357.13168,[M+FA]-,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457971,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,313.14075,[M+H]+,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457972,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,313.14075,[M+H]+,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457973,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,313.14075,[M+H]+,60.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457974,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,313.14075,[M+H]+,30.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457975,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1,313.14075,[M+H]+,20.0,val,O=C1NCCN1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1
457976,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457977,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457978,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,45.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457979,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457980,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457981,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,20.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457982,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,60.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457983,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1,313.14075,[M+H]+,45.0,val,Cc1nccn1-c1cc(NCCNC(=O)c2ccco2)ncn1
457984,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1,313.14075,[M+H]+,20.0,val,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1
457985,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1,313.14075,[M+H]+,20.0,val,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1
457986,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1,313.14075,[M+H]+,60.0,val,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1
457987,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1,313.14075,[M+H]+,15.0,val,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1
457988,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1,313.14075,[M+H]+,20.0,val,COc1ccc(CNc2cc(-n3cncn3)ncn2)c(OC)c1
457989,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457990,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457991,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,30.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457992,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,15.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457993,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457994,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457995,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457996,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,313.14075,[M+H]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457997,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457998,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
457999,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458000,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,30.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458001,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458002,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,60.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458003,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,30.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458004,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1,335.12269,[M+Na]+,20.0,val,CC(C)c1nc(NC(=O)Cn2cnc3ccccc3c2=O)n[nH]1
458005,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458006,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458007,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458008,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,30.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458009,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458010,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,30.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458011,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,20.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458012,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12,313.14075,[M+H]+,60.0,val,Cc1cc(=O)[nH]c2cc(NC(=O)CCCn3cnnn3)ccc12
458013,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,20.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458014,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,20.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458015,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,45.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458016,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,60.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458017,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,20.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458018,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,60.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458019,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,45.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458020,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12,313.12299,[M+H]+,20.0,val,Cc1csc2c(N3CCN(c4ncccn4)CC3)ncnc12
458021,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458022,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458023,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,30.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458024,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,60.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458025,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,15.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458026,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458027,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,60.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458028,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1,313.12299,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCc2ccccn2)cc1
458029,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,20.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458030,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,20.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458031,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,60.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458032,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,20.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458033,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,60.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458034,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12,313.12299,[M+H]+,20.0,val,Cc1nc2ccccn2c1-c1nnc2sc(C(C)(C)C)nn12
458035,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,20.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458036,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,20.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458037,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,60.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458038,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,30.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458039,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,20.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458040,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,60.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458041,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,30.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458042,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1,313.12299,[M+H]+,20.0,val,CSc1ncc(C#N)c(N(C)C2CN(c3ccccn3)C2)n1
458043,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,353.08781,[M+FA]-,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458044,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,353.08781,[M+FA]-,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458045,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,353.08781,[M+FA]-,60.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458046,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,353.08781,[M+FA]-,15.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458047,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,353.08781,[M+FA]-,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458048,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,309.09688,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458049,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,309.09688,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458050,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,309.09688,[M+H]+,60.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458051,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,309.09688,[M+H]+,15.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458052,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12,309.09688,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12
458053,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458054,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458055,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458056,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458057,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458058,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458059,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458060,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458061,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458062,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458063,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458064,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458065,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458066,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458067,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458068,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458069,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458070,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458071,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,341.08671,[M+H]+,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458072,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,341.08671,[M+H]+,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458073,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458074,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,341.08671,[M+H]+,60.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458075,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1,341.08671,[M+H]+,30.0,val,O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1
458076,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458077,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458078,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,341.08671,[M+H]+,60.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458079,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,341.08671,[M+H]+,15.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458080,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2o1
458081,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458082,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458083,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458084,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458085,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458086,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,30.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458087,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,60.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458088,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,339.07216,[M-H]-,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458089,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458090,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458091,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,60.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458092,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,30.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458093,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458094,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,45.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458095,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,20.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458096,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,341.08671,[M+H]+,60.0,val,O=c1ccc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
458097,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,347.0513,[M-H]-,30.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458098,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,347.0513,[M-H]-,60.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458099,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,347.0513,[M-H]-,30.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458100,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458101,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458102,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,60.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458103,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,30.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458104,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458105,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,60.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458106,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,30.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458107,O=C(NCCN1CCCC1)c1cc2nccnc2c(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NCCN1CCCC1)c1cc(Br)c2nccnc2c1
458108,Cc1c(C(=O)N2CCCC2c2nncn2C)cc(Br)cc1,349.06585,[M+H]+,20.0,val,Cc1ccc(Br)cc1C(=O)N1CCCC1c1nncn1C
458109,Cc1c(C(=O)N2CCCC2c2nncn2C)cc(Br)cc1,349.06585,[M+H]+,20.0,val,Cc1ccc(Br)cc1C(=O)N1CCCC1c1nncn1C
458110,Cc1c(C(=O)N2CCCC2c2nncn2C)cc(Br)cc1,349.06585,[M+H]+,60.0,val,Cc1ccc(Br)cc1C(=O)N1CCCC1c1nncn1C
458111,Cc1c(C(=O)N2CCCC2c2nncn2C)cc(Br)cc1,349.06585,[M+H]+,30.0,val,Cc1ccc(Br)cc1C(=O)N1CCCC1c1nncn1C
458112,Cc1c(C(=O)N2CCCC2c2nncn2C)cc(Br)cc1,349.06585,[M+H]+,20.0,val,Cc1ccc(Br)cc1C(=O)N1CCCC1c1nncn1C
458113,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,349.06585,[M+H]+,20.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458114,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,349.06585,[M+H]+,20.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458115,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,349.06585,[M+H]+,60.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458116,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,349.06585,[M+H]+,30.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458117,Cn1cc(CCNC(=O)c2c(C3CC3)ncc(Br)c2)cn1,349.06585,[M+H]+,20.0,val,Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1
458118,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458119,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458120,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,347.0513,[M-H]-,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458121,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,347.0513,[M-H]-,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458122,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458123,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458124,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,349.06585,[M+H]+,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458125,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458126,O=C(NC1CN2CCC1CC2)c1c2nc[nH]c2cc(Br)c1,349.06585,[M+H]+,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458127,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458128,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458129,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,75.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458130,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458131,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458132,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,75.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458133,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458134,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,347.0513,[M-H]-,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458135,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,393.05678,[M+FA]-,60.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458136,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,393.05678,[M+FA]-,15.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458137,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,393.05678,[M+FA]-,20.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458138,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,20.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458139,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,20.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458140,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,30.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458141,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,60.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458142,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,20.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458143,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,45.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458144,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,60.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458145,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,20.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458146,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C,349.06585,[M+H]+,45.0,val,Cc1ncnc(N2CCC(Oc3ccncc3Br)C2)c1C
458147,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458148,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458149,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,349.06585,[M+H]+,60.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458150,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,349.06585,[M+H]+,15.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458151,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12,349.06585,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12
458152,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,20.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458153,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,20.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458154,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,30.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458155,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,60.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458156,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,20.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458157,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,45.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458158,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,60.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458159,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1,349.06585,[M+H]+,20.0,val,CCc1cnc(N2CCC(Oc3ccncc3Br)C2)nc1
458160,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,349.06585,[M+H]+,30.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458161,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,349.06585,[M+H]+,30.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458162,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,349.06585,[M+H]+,20.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458163,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,349.06585,[M+H]+,60.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458164,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1,349.06585,[M+H]+,30.0,val,O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1
458165,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,291.09058,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458166,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,291.09058,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458167,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,291.09058,[M-H]-,60.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458168,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,291.09058,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458169,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,291.09058,[M-H]-,45.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458170,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,293.10513,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458171,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,293.10513,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458172,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,293.10513,[M+H]+,60.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458173,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,293.10513,[M+H]+,30.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458174,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1CCOC1,293.10513,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cc(Cl)ccc12)NCC1CCOC1
458175,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,327.06726,[M+Cl]-,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458176,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,327.06726,[M+Cl]-,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458177,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,327.06726,[M+Cl]-,60.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458178,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,327.06726,[M+Cl]-,15.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458179,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,327.06726,[M+Cl]-,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458180,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,257.08401,[M+H-2H2O]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458181,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,257.08401,[M+H-2H2O]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458182,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,257.08401,[M+H-2H2O]+,60.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458183,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,257.08401,[M+H-2H2O]+,15.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458184,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,257.08401,[M+H-2H2O]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458185,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458186,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458187,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,60.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458188,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,30.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458189,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458190,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,60.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458191,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,30.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458192,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1,293.10513,[M+H]+,20.0,val,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
458193,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,20.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458194,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,20.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458195,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,45.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458196,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,60.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458197,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,20.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458198,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,45.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458199,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,60.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458200,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1,321.11799,[M+H]+,20.0,val,Fc1ccc(OCC2CCN(c3nc(C4CC4)ns3)C2)nc1
458201,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458202,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458203,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,60.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458204,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458205,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,45.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458206,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,60.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458207,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458208,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,363.1045,[M-H]-,45.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458209,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,399.08117,[M+Cl]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458210,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,399.08117,[M+Cl]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458211,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,399.08117,[M+Cl]-,60.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458212,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,399.08117,[M+Cl]-,15.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458213,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,399.08117,[M+Cl]-,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458214,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,365.11905,[M+H]+,45.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458215,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,365.11905,[M+H]+,45.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458216,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,365.11905,[M+H]+,20.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458217,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,365.11905,[M+H]+,60.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458218,CC(C)(C)NS(=O)(=O)c1cncc(-c2cn3nc(N)nc3c(F)c2)c1,365.11905,[M+H]+,45.0,val,CC(C)(C)NS(=O)(=O)c1cncc(-c2cc(F)c3nc(N)nn3c2)c1
458219,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,254.12989,[M-H]-,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458220,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,254.12989,[M-H]-,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458221,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,254.12989,[M-H]-,60.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458222,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,254.12989,[M-H]-,30.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458223,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,254.12989,[M-H]-,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458224,O=C(Nc1cccc2ccccc12)NC1CCNC1,254.12989,[M-H]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458225,O=C(Nc1cccc2ccccc12)NC1CCNC1,254.12989,[M-H]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458226,O=C(Nc1cccc2ccccc12)NC1CCNC1,254.12989,[M-H]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458227,O=C(Nc1cccc2ccccc12)NC1CCNC1,300.13536,[M+FA]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458228,O=C(Nc1cccc2ccccc12)NC1CCNC1,300.13536,[M+FA]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458229,O=C(Nc1cccc2ccccc12)NC1CCNC1,300.13536,[M+FA]-,60.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458230,O=C(Nc1cccc2ccccc12)NC1CCNC1,300.13536,[M+FA]-,15.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458231,O=C(Nc1cccc2ccccc12)NC1CCNC1,300.13536,[M+FA]-,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458232,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,254.12989,[M-H]-,15.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458233,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,254.12989,[M-H]-,15.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458234,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,254.12989,[M-H]-,20.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458235,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,254.12989,[M-H]-,60.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458236,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,254.12989,[M-H]-,15.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458237,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,254.12989,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458238,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,254.12989,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458239,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,254.12989,[M-H]-,60.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458240,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,254.12989,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458241,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,254.12989,[M-H]-,45.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458242,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458243,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458244,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,60.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458245,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,30.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458246,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458247,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,60.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458248,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,30.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458249,O=C(Nc1cc2ccccc2nc1)NC1CCCC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cnc2ccccc2c1)NC1CCCC1
458250,O=C(NC1CCNCC1)c1c2ncccc2ccc1,256.14444,[M+H]+,20.0,val,O=C(NC1CCNCC1)c1cccc2cccnc12
458251,O=C(NC1CCNCC1)c1c2ncccc2ccc1,256.14444,[M+H]+,20.0,val,O=C(NC1CCNCC1)c1cccc2cccnc12
458252,O=C(NC1CCNCC1)c1c2ncccc2ccc1,256.14444,[M+H]+,60.0,val,O=C(NC1CCNCC1)c1cccc2cccnc12
458253,O=C(NC1CCNCC1)c1c2ncccc2ccc1,256.14444,[M+H]+,30.0,val,O=C(NC1CCNCC1)c1cccc2cccnc12
458254,O=C(NC1CCNCC1)c1c2ncccc2ccc1,256.14444,[M+H]+,20.0,val,O=C(NC1CCNCC1)c1cccc2cccnc12
458255,CNC(=O)c1cc(NCc2ccncc2)c(C)cc1,256.14444,[M+H]+,20.0,val,CNC(=O)c1ccc(C)c(NCc2ccncc2)c1
458256,CNC(=O)c1cc(NCc2ccncc2)c(C)cc1,256.14444,[M+H]+,20.0,val,CNC(=O)c1ccc(C)c(NCc2ccncc2)c1
458257,CNC(=O)c1cc(NCc2ccncc2)c(C)cc1,256.14444,[M+H]+,60.0,val,CNC(=O)c1ccc(C)c(NCc2ccncc2)c1
458258,CNC(=O)c1cc(NCc2ccncc2)c(C)cc1,256.14444,[M+H]+,15.0,val,CNC(=O)c1ccc(C)c(NCc2ccncc2)c1
458259,CNC(=O)c1cc(NCc2ccncc2)c(C)cc1,256.14444,[M+H]+,20.0,val,CNC(=O)c1ccc(C)c(NCc2ccncc2)c1
458260,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458261,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458262,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458263,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458264,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,45.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458265,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458266,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458267,Cc1n[nH]c(C)c1NC(=O)c1cc2c(cc1)CCC2,256.14444,[M+H]+,45.0,val,Cc1n[nH]c(C)c1NC(=O)c1ccc2c(c1)CCC2
458268,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1,256.14444,[M+H]+,20.0,val,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1
458269,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1,256.14444,[M+H]+,20.0,val,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1
458270,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1,256.14444,[M+H]+,60.0,val,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1
458271,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1,256.14444,[M+H]+,30.0,val,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1
458272,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1,256.14444,[M+H]+,20.0,val,CN(C)C(=O)c1ccc(NCc2ccncc2)cc1
458273,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458274,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458275,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,60.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458276,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,30.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458277,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458278,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,60.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458279,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,30.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458280,O=C(Nc1cccc2ccccc12)NC1CCNC1,256.14444,[M+H]+,20.0,val,O=C(Nc1cccc2ccccc12)NC1CCNC1
458281,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,20.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458282,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,20.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458283,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,60.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458284,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,15.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458285,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,20.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458286,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,60.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458287,CNc1nc2ccccc2c(C(=O)N2CCCC2)c1,256.14444,[M+H]+,20.0,val,CNc1cc(C(=O)N2CCCC2)c2ccccc2n1
458288,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458289,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458290,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,60.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458291,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458292,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,60.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458293,Cc1nc2c(cc(NC(=O)C3CC4CC4C3)cc2)[nH]1,256.14444,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)C3CC4CC4C3)cc2[nH]1
458294,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,20.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458295,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,20.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458296,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,60.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458297,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,30.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458298,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,20.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458299,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,60.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458300,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,30.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458301,O=C(NCc1cc2c(cc1)nccc2)NCC1CC1,256.14444,[M+H]+,20.0,val,O=C(NCc1ccc2ncccc2c1)NCC1CC1
458302,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458303,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458304,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,60.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458305,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458306,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,45.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458307,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,60.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458308,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,20.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458309,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1,256.14444,[M+H]+,45.0,val,Cc1ccccc1NC(=O)Cn1ccnc1C1CC1
458310,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,20.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458311,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,20.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458312,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,45.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458313,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,60.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458314,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,20.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458315,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,45.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458316,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,20.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458317,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1,256.14444,[M+H]+,60.0,val,CC(C)(C)[C@@H]1COC(c2ccc3cccnc3n2)=N1
458318,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458319,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458320,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,60.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458321,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,30.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458322,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458323,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,60.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458324,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,30.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458325,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,350.06386,[M-H]-,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458326,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,352.07841,[M+H]+,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458327,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,352.07841,[M+H]+,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458328,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,352.07841,[M+H]+,60.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458329,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,352.07841,[M+H]+,30.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458330,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1,352.07841,[M+H]+,20.0,val,C=CCCC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1
458331,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458332,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458333,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,60.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458334,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,45.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458335,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,60.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458336,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,350.06386,[M-H]-,45.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458337,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1,352.07841,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1
458338,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1,352.07841,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1
458339,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1,352.07841,[M+H]+,60.0,val,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1
458340,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1,352.07841,[M+H]+,15.0,val,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1
458341,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1,352.07841,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N(CCc2cccs2)Cc2ccco2)c1
458342,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458343,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458344,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,60.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458345,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,30.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458346,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458347,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,60.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458348,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,30.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458349,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)Nc2nccs2)cc1,352.07841,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCCC1
458350,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458351,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458352,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,60.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458353,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,30.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458354,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458355,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,60.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458356,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,30.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458357,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,334.0867,[M-H]-,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458358,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,20.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458359,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,20.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458360,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,60.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458361,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,30.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458362,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,20.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458363,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,60.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458364,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,30.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458365,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1,334.0867,[M-H]-,20.0,val,CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccnn1C1CCC1
458366,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,334.0867,[M-H]-,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458367,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,334.0867,[M-H]-,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458368,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,334.0867,[M-H]-,60.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458369,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,334.0867,[M-H]-,30.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458370,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,334.0867,[M-H]-,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458371,CCOC(=O)c1c2N(S(=O)(=O)c3cccc(C)c3)CCn2nc1,336.10125,[M+H]+,20.0,val,CCOC(=O)c1cnn2c1N(S(=O)(=O)c1cccc(C)c1)CC2
458372,CCOC(=O)c1c2N(S(=O)(=O)c3cccc(C)c3)CCn2nc1,336.10125,[M+H]+,20.0,val,CCOC(=O)c1cnn2c1N(S(=O)(=O)c1cccc(C)c1)CC2
458373,CCOC(=O)c1c2N(S(=O)(=O)c3cccc(C)c3)CCn2nc1,336.10125,[M+H]+,60.0,val,CCOC(=O)c1cnn2c1N(S(=O)(=O)c1cccc(C)c1)CC2
458374,CCOC(=O)c1c2N(S(=O)(=O)c3cccc(C)c3)CCn2nc1,336.10125,[M+H]+,30.0,val,CCOC(=O)c1cnn2c1N(S(=O)(=O)c1cccc(C)c1)CC2
458375,CCOC(=O)c1c2N(S(=O)(=O)c3cccc(C)c3)CCn2nc1,336.10125,[M+H]+,20.0,val,CCOC(=O)c1cnn2c1N(S(=O)(=O)c1cccc(C)c1)CC2
458376,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,20.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458377,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,20.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458378,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,60.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458379,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,30.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458380,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,20.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458381,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,60.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458382,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,30.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458383,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1,336.10125,[M+H]+,20.0,val,Cn1cc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)c(C2CC2)n1
458384,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,336.10125,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458385,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,336.10125,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458386,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,336.10125,[M+H]+,60.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458387,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,336.10125,[M+H]+,20.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458388,Cc1c(S(=O)(=O)N2CCc3c(cc(C(=O)O)cc3)C2)n(C)nc1,336.10125,[M+H]+,45.0,val,Cc1cnn(C)c1S(=O)(=O)N1CCc2ccc(C(=O)O)cc2C1
458389,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458390,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458391,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,60.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458392,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,30.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458393,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458394,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,60.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458395,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,30.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458396,COc1c(S(=O)(=O)N2CCc3c(C2)c(=O)[nH]cn3)cc(C)cc1,336.10125,[M+H]+,20.0,val,COc1ccc(C)cc1S(=O)(=O)N1CCc2nc[nH]c(=O)c2C1
458397,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458398,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458399,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,60.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458400,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,30.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458401,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458402,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,30.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458403,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458404,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,334.0867,[M-H]-,60.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458405,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,336.10125,[M+H]+,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458406,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,336.10125,[M+H]+,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458407,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,336.10125,[M+H]+,60.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458408,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,336.10125,[M+H]+,15.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458409,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1,336.10125,[M+H]+,20.0,val,Cc1ccc(CNS(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)o1
458410,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1,336.10125,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1
458411,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1,336.10125,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1
458412,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1,336.10125,[M+H]+,60.0,val,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1
458413,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1,336.10125,[M+H]+,15.0,val,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1
458414,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1,336.10125,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N1CCC(Oc2nccs2)C1
458415,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458416,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458417,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,60.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458418,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,30.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458419,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458420,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,60.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458421,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,30.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458422,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,350.08162,[M-H]-,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458423,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,352.09617,[M+H]+,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458424,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,352.09617,[M+H]+,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458425,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,352.09617,[M+H]+,60.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458426,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,352.09617,[M+H]+,15.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458427,COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C(=O)O)cn[nH]1,352.09617,[M+H]+,20.0,val,COc1ccccc1CN(C1CC1)S(=O)(=O)c1[nH]ncc1C(=O)O
458428,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458429,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458430,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,60.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458431,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458432,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,45.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458433,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,60.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458434,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458435,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,330.10302,[M-H]-,45.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458436,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,332.11757,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458437,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,332.11757,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458438,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,332.11757,[M+H]+,60.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458439,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,332.11757,[M+H]+,15.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458440,O=S(=O)(Nc1c2[nH]ncc2ccc1)c1ccnn1CC1CCC1,332.11757,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2cn[nH]c12)c1ccnn1CC1CCC1
458441,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,20.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458442,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,20.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458443,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,60.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458444,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,20.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458445,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,45.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458446,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,60.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458447,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,20.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458448,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2c3cc(C)sc3ncn2)C1,332.11757,[M+H]+,45.0,val,CO[C@H]1C[C@H](c2nnc(C)o2)N(c2ncnc3sc(C)cc23)C1
458449,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458450,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458451,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,330.10302,[M-H]-,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458452,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,330.10302,[M-H]-,15.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458453,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458454,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458455,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458456,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,376.1085,[M+FA]-,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458457,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,376.1085,[M+FA]-,15.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458458,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458459,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,376.1085,[M+FA]-,20.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458460,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,376.1085,[M+FA]-,60.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458461,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,376.1085,[M+FA]-,15.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458462,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,376.1085,[M+FA]-,20.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458463,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,332.11757,[M+H]+,20.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458464,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,332.11757,[M+H]+,20.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458465,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,332.11757,[M+H]+,60.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458466,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,332.11757,[M+H]+,30.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458467,NC(=O)C1CCN(C(=O)c2c(N)c(-c3ccccn3)ns2)CC1,332.11757,[M+H]+,20.0,val,NC(=O)C1CCN(C(=O)c2snc(-c3ccccn3)c2N)CC1
458468,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458469,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458470,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,332.11757,[M+H]+,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458471,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,332.11757,[M+H]+,30.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458472,CCn1nccc1C(=O)NCCn1c(C)nc2c(ccs2)c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458473,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458474,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458475,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458476,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,15.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458477,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458478,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458479,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,330.10302,[M-H]-,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458480,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458481,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458482,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,376.1085,[M+FA]-,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458483,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,376.1085,[M+FA]-,15.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458484,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,376.1085,[M+FA]-,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458485,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458486,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458487,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458488,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,30.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458489,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458490,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,20.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458491,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,60.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458492,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O,332.11757,[M+H]+,30.0,val,CCn1nccc1C(=O)NCCn1c(C)nc2sccc2c1=O
458493,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,20.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458494,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,20.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458495,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,60.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458496,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,15.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458497,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,20.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458498,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,60.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458499,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,20.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458500,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1,332.11757,[M+H]+,15.0,val,Cc1noc(C2CCCCN2Cc2nc(-c3cccs3)no2)n1
458501,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458502,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458503,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,60.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458504,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,30.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458505,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458506,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,60.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458507,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,30.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458508,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,330.08526,[M-H]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458509,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,366.06194,[M+Cl]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458510,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,366.06194,[M+Cl]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458511,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,366.06194,[M+Cl]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458512,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,376.09074,[M+FA]-,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458513,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,376.09074,[M+FA]-,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458514,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,376.09074,[M+FA]-,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458515,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,376.09074,[M+FA]-,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458516,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,332.09981,[M+H]+,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458517,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,332.09981,[M+H]+,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458518,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,332.09981,[M+H]+,20.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458519,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,332.09981,[M+H]+,60.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458520,Cc1c(CNc2c3c4c(CC(C)CC4)sc3ncn2)snn1,332.09981,[M+H]+,15.0,val,Cc1nnsc1CNc1ncnc2sc3c(c12)CCC(C)C3
458521,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,20.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458522,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,20.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458523,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,60.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458524,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,20.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458525,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,60.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458526,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1,332.09981,[M+H]+,20.0,val,CCc1nnc(C2CCN(c3ncnc4ccsc34)CC2)s1
458527,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458528,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458529,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,60.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458530,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,30.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458531,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458532,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,60.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458533,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,30.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458534,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,322.07547,[M-H]-,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458535,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,368.08095,[M+FA]-,15.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458536,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,368.08095,[M+FA]-,15.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458537,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,368.08095,[M+FA]-,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458538,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,368.08095,[M+FA]-,60.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458539,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,368.08095,[M+FA]-,15.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458540,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,324.09002,[M+H]+,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458541,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,324.09002,[M+H]+,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458542,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,324.09002,[M+H]+,60.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458543,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,324.09002,[M+H]+,30.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458544,CS(=O)(=O)c1cc(C(=O)O)cc(NC(=O)CC2C=CCC2)c1,324.09002,[M+H]+,20.0,val,CS(=O)(=O)c1cc(NC(=O)CC2C=CCC2)cc(C(=O)O)c1
458545,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458546,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458547,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,30.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458548,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,60.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458549,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,15.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458550,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458551,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458552,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,322.07547,[M-H]-,60.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458553,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,324.09002,[M+H]+,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458554,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,324.09002,[M+H]+,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458555,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,324.09002,[M+H]+,60.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458556,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,324.09002,[M+H]+,15.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458557,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O,324.09002,[M+H]+,20.0,val,COC(=O)c1cc(C)sc1NC(=O)C1CC=CCC1C(=O)O
458558,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C,336.0706,[M+H]+,20.0,val,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C
458559,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C,336.0706,[M+H]+,20.0,val,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C
458560,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C,336.0706,[M+H]+,60.0,val,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C
458561,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C,336.0706,[M+H]+,15.0,val,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C
458562,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C,336.0706,[M+H]+,20.0,val,C[C@@H](c1nc(C2(c3ccccc3Br)CC2)no1)N(C)C
458563,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br,336.0706,[M+H]+,20.0,val,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br
458564,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br,336.0706,[M+H]+,20.0,val,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br
458565,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br,336.0706,[M+H]+,60.0,val,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br
458566,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br,336.0706,[M+H]+,20.0,val,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br
458567,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br,336.0706,[M+H]+,60.0,val,Cc1nc2nc(N3CCC(O)CC3)ccc2c(C)c1Br
458568,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,20.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458569,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,20.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458570,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,45.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458571,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,60.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458572,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,20.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458573,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,45.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458574,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,20.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458575,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1,336.0706,[M+H]+,60.0,val,Brc1cnn(CC2CN(CCOc3ccccc3)C2)c1
458576,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,20.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458577,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,20.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458578,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,60.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458579,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,30.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458580,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,20.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458581,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,60.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458582,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,30.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458583,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1,336.0706,[M+H]+,20.0,val,COc1ccc(CN2CC(Cn3cc(Br)cn3)C2)cc1
458584,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1,336.0706,[M+H]+,20.0,val,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1
458585,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1,336.0706,[M+H]+,20.0,val,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1
458586,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1,336.0706,[M+H]+,60.0,val,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1
458587,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1,336.0706,[M+H]+,15.0,val,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1
458588,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1,336.0706,[M+H]+,20.0,val,Cc1ccc(C(C)NC(=O)c2nn(C)c(C)c2Br)cc1
458589,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1,368.04267,[M+H]+,15.0,val,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1
458590,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1,368.04267,[M+H]+,15.0,val,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1
458591,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1,368.04267,[M+H]+,20.0,val,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1
458592,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1,368.04267,[M+H]+,60.0,val,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1
458593,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1,368.04267,[M+H]+,15.0,val,Cc1nc(C)c(CN2CCC(Oc3ccncc3Br)C2)s1
458594,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,20.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458595,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,20.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458596,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,60.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458597,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,30.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458598,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,20.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458599,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,60.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458600,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,30.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458601,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1,368.04267,[M+H]+,20.0,val,Brc1ccc(CN2CCCC(COc3ncccn3)C2)s1
458602,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,20.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458603,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,20.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458604,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,60.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458605,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,20.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458606,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,45.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458607,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,60.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458608,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,20.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458609,C[C@]1(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2)C[C@H]2CC[C@@H]1O2,342.05723,[M-H]-,45.0,val,C[C@]1(C(=O)NS(=O)(=O)Cc2cccc(Cl)c2)C[C@H]2CC[C@@H]1O2
458610,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458611,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458612,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458613,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,30.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458614,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458615,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458616,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,30.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458617,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1,342.05723,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1
458618,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458619,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458620,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458621,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458622,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458623,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458624,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458625,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,335.14374,[M-H]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458626,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458627,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458628,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458629,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458630,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458631,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458632,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458633,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,371.12042,[M+Cl]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458634,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458635,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458636,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458637,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458638,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458639,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458640,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458641,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,381.14922,[M+FA]-,15.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458642,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458643,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458644,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458645,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458646,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458647,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458648,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458649,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,335.14374,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458650,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458651,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458652,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458653,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458654,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458655,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458656,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458657,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F,337.15829,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(c3ncncc3F)CC2)[nH]c(=O)c1F
458658,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,337.15829,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
458659,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,337.15829,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
458660,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,337.15829,[M+H]+,45.0,val,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
458661,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,337.15829,[M+H]+,60.0,val,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
458662,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1,337.15829,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCN(c3nc(C(F)F)cc(=O)[nH]3)CC2)n1
458663,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458664,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458665,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,30.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458666,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458667,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458668,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,45.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458669,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,60.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458670,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1,337.15829,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)Nc2cc(F)cc(F)c2)c(N(C)C)n1
458671,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,20.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458672,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,20.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458673,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,60.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458674,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,20.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458675,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,45.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458676,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,60.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458677,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,20.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458678,Cc1c(C)c2nnc(C(F)(F)F)n2nc1N1CCC2(CCO2)CC1,342.15362,[M+H]+,45.0,val,Cc1c(N2CCC3(CCO3)CC2)nn2c(C(F)(F)F)nnc2c1C
458679,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,20.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458680,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,20.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458681,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,45.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458682,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,60.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458683,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,20.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458684,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,45.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458685,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,60.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458686,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1,342.15362,[M+H]+,20.0,val,Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1
458687,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,348.14774,[M+FA]-,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458688,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,348.14774,[M+FA]-,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458689,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,348.14774,[M+FA]-,60.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458690,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,348.14774,[M+FA]-,15.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458691,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,348.14774,[M+FA]-,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458692,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,304.15681,[M+H]+,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458693,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,304.15681,[M+H]+,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458694,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,304.15681,[M+H]+,60.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458695,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,304.15681,[M+H]+,15.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458696,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1,304.15681,[M+H]+,20.0,val,CC(NC(=O)C1CCNc2c1nnn2C)c1ccc(F)cc1
458697,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458698,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458699,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,60.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458700,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,30.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458701,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458702,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,60.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458703,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,30.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458704,CCc1c(F)c(NCCn2cnc(C3CC3)cc2=O)ncn1,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458705,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458706,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458707,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,60.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458708,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,30.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458709,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458710,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,30.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458711,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,20.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458712,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F,304.15681,[M+H]+,60.0,val,CCc1ncnc(NCCn2cnc(C3CC3)cc2=O)c1F
458713,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458714,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458715,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458716,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,30.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458717,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458718,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,30.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458719,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458720,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1,304.15681,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(CNC(=O)Nc2ccccc2F)n1
458721,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458722,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458723,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,60.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458724,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,15.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458725,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458726,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,60.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458727,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,15.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458728,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1,304.15681,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(c3ncc(F)cn3)C2)nc1
458729,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1,304.15681,[M+H]+,20.0,val,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1
458730,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1,304.15681,[M+H]+,20.0,val,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1
458731,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1,304.15681,[M+H]+,60.0,val,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1
458732,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1,304.15681,[M+H]+,15.0,val,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1
458733,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1,304.15681,[M+H]+,20.0,val,CCc1cnc(OC2CCN(c3ncc(F)cn3)CC2)nc1
458734,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,318.13718,[M-H]-,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458735,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,318.13718,[M-H]-,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458736,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,318.13718,[M-H]-,60.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458737,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,318.13718,[M-H]-,15.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458738,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,318.13718,[M-H]-,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458739,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458740,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458741,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,60.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458742,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,30.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458743,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458744,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,60.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458745,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,30.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458746,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1,320.15173,[M+H]+,20.0,val,Cn1cnnc1N1CCN(C(C(=O)O)c2ccc(F)cc2)CC1
458747,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458748,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458749,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,60.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458750,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,30.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458751,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458752,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,60.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458753,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,30.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458754,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,320.15173,[M+H]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458755,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,342.13367,[M+Na]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458756,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,342.13367,[M+Na]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458757,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,342.13367,[M+Na]+,30.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458758,CC1COCCCN1C(=O)Nc1nn(-c2c(F)cccn2)cc1,342.13367,[M+Na]+,20.0,val,CC1COCCCN1C(=O)Nc1ccn(-c2ncccc2F)n1
458759,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458760,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458761,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458762,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458763,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,45.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458764,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458765,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458766,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458767,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,30.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458768,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458769,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458770,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,30.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458771,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458772,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,318.13718,[M-H]-,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458773,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,318.13718,[M-H]-,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458774,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,318.13718,[M-H]-,60.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458775,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,318.13718,[M-H]-,30.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458776,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,318.13718,[M-H]-,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458777,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458778,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458779,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,45.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458780,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458781,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,318.13718,[M-H]-,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458782,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458783,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458784,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,45.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458785,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,60.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458786,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458787,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,45.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458788,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,60.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458789,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1,320.15173,[M+H]+,20.0,val,O=C1CN(C2CCN(c3ncncc3F)CC2)C(=O)N1C1CC1
458790,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458791,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458792,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458793,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,30.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458794,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458795,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,30.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458796,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,60.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458797,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F,320.15173,[M+H]+,20.0,val,O=c1[nH]c(N2CCN(Cc3cocn3)CC2)nc(C2CC2)c1F
458798,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458799,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458800,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458801,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,30.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458802,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458803,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,45.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458804,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458805,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,342.06394,[M-H]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458806,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,378.04062,[M+Cl]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458807,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,378.04062,[M+Cl]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458808,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,378.04062,[M+Cl]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458809,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,378.04062,[M+Cl]-,15.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458810,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,378.04062,[M+Cl]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458811,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,388.06942,[M+FA]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458812,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,388.06942,[M+FA]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458813,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,388.06942,[M+FA]-,60.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458814,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1,388.06942,[M+FA]-,20.0,val,CC(O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1
458815,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,273.12447,[M-H]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458816,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,273.12447,[M-H]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458817,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,273.12447,[M-H]-,60.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458818,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,273.12447,[M-H]-,30.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458819,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,273.12447,[M-H]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458820,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,319.12994,[M+FA]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458821,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,319.12994,[M+FA]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458822,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,319.12994,[M+FA]-,60.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458823,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,319.12994,[M+FA]-,15.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458824,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,319.12994,[M+FA]-,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458825,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,275.13902,[M+H]+,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458826,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,275.13902,[M+H]+,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458827,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,275.13902,[M+H]+,60.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458828,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,275.13902,[M+H]+,15.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458829,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1,275.13902,[M+H]+,20.0,val,O=C1CC(C(=O)NC2c3ccccc3CC2O)CCN1
458830,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O,275.13902,[M+H]+,20.0,val,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O
458831,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O,275.13902,[M+H]+,20.0,val,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O
458832,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O,275.13902,[M+H]+,60.0,val,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O
458833,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O,275.13902,[M+H]+,30.0,val,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O
458834,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O,275.13902,[M+H]+,20.0,val,CC1OC2(CCN(C(=O)c3ccccc3)CC2)NC1=O
458835,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1,275.13902,[M+H]+,20.0,val,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1
458836,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1,275.13902,[M+H]+,20.0,val,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1
458837,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1,275.13902,[M+H]+,60.0,val,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1
458838,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1,275.13902,[M+H]+,30.0,val,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1
458839,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1,275.13902,[M+H]+,20.0,val,O=C(CC1CCNC1=O)NC1(c2ccccc2)COC1
458840,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458841,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458842,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,60.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458843,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458844,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,45.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458845,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,60.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458846,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458847,CCOC(=O)c1cc2c(ccc(N3CCNCC3)c2)o1,275.13902,[M+H]+,45.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458848,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458849,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458850,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,60.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458851,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,30.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458852,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458853,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,273.12447,[M-H]-,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458854,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,273.12447,[M-H]-,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458855,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,273.12447,[M-H]-,60.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458856,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,273.12447,[M-H]-,30.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458857,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,273.12447,[M-H]-,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458858,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458859,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458860,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,60.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458861,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,30.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458862,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458863,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458864,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458865,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,60.0,val,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458866,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,30.0,val,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458867,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,273.12447,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458868,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458869,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458870,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,273.12447,[M-H]-,60.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458871,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,273.12447,[M-H]-,30.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458872,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458873,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458874,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458875,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,273.12447,[M-H]-,30.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458876,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,273.12447,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458877,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458878,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458879,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,275.13902,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458880,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,275.13902,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458881,CC(C)[C@H](NC(=O)c1cc2c(cc1)ccn2C)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2ccn(C)c2c1)C(=O)O
458882,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458883,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458884,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458885,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,60.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458886,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,30.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458887,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O,275.13902,[M+H]+,20.0,val,CCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)O
458888,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458889,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458890,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,275.13902,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458891,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,275.13902,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458892,CC(C)[C@H](NC(=O)c1cc2c(cc1)n(C)cc2)C(=O)O,275.13902,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1ccc2c(ccn2C)c1)C(=O)O
458893,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,275.13902,[M+H]+,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458894,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,275.13902,[M+H]+,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458895,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,275.13902,[M+H]+,60.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458896,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,275.13902,[M+H]+,15.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458897,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O,275.13902,[M+H]+,20.0,val,CCC(NC(=O)CCc1c[nH]c2ccccc12)C(=O)O
458898,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458899,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458900,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,45.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458901,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,60.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458902,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458903,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,20.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458904,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,45.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458905,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1,275.13902,[M+H]+,60.0,val,CCOC(=O)c1cc2cc(N3CCNCC3)ccc2o1
458906,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458907,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458908,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,60.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458909,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,15.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458910,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458911,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O,247.13287,[M+H]+,20.0,val,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O
458912,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O,247.13287,[M+H]+,20.0,val,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O
458913,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O,247.13287,[M+H]+,15.0,val,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O
458914,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O,247.13287,[M+H]+,60.0,val,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O
458915,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O,247.13287,[M+H]+,20.0,val,CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O
458916,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458917,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458918,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,60.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458919,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,15.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458920,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1,264.15942,[M+NH4]+,20.0,val,CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
458921,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458922,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458923,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,60.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458924,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,30.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458925,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458926,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,60.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458927,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,30.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458928,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,247.13287,[M+H]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458929,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458930,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458931,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,60.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458932,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,15.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458933,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458934,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,60.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458935,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,15.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458936,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458937,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,269.11481,[M+Na]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458938,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,269.11481,[M+Na]+,30.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458939,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O,269.11481,[M+Na]+,20.0,val,C/C1=C/CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458940,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458941,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458942,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,60.0,val,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458943,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,15.0,val,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458944,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O,264.15942,[M+NH4]+,20.0,val,C/C1=C\CCC2=CC(OC2=O)C(C)(C)C=CC1=O
458945,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,247.13287,[M+H]+,20.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458946,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,247.13287,[M+H]+,20.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458947,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,247.13287,[M+H]+,60.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458948,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,247.13287,[M+H]+,15.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458949,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,247.13287,[M+H]+,20.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458950,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,269.11481,[M+Na]+,20.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458951,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C1)occ2C,269.11481,[M+Na]+,20.0,val,C/C1=C\CC[C@]2(C)O[C@H]2C(=O)c2c(C)coc2C1
458952,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458953,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458954,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458955,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458956,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458957,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458958,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458959,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,30.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458960,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458961,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458962,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,45.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458963,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458964,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,277.09039,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458965,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458966,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458967,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458968,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458969,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458970,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458971,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458972,Cc1c2cc(C(C)C)ccc(C)c-2c(S(=O)(=O)O)c1,279.10494,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
458973,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458974,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458975,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,45.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458976,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,60.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458977,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458978,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458979,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458980,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,60.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458981,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,30.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458982,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458983,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,30.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458984,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,60.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458985,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1,301.15222,[M+H]+,20.0,val,O=C(CN1CCC(C(F)(F)F)CC1)NCc1ccccc1
458986,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458987,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458988,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,60.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458989,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,30.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458990,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458991,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,60.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458992,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,30.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458993,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,379.09449,[M-H]-,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458994,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458995,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458996,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,60.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458997,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,30.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458998,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
458999,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,60.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
459000,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,30.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
459001,Cc1c(S(=O)(=O)NC2CCN(CC(=O)O)CC2)ccc(C(F)(F)F)c1,381.10904,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NC1CCN(CC(=O)O)CC1
459002,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,289.14701,[M-H]-,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459003,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,289.14701,[M-H]-,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459004,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,289.14701,[M-H]-,60.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459005,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,289.14701,[M-H]-,15.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459006,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,289.14701,[M-H]-,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459007,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459008,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459009,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,60.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459010,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,30.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459011,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459012,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,60.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459013,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,30.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459014,CCNC(=O)N1CCC(c2nc3c(cccc3F)[nH]2)CC1,291.16156,[M+H]+,20.0,val,CCNC(=O)N1CCC(c2nc3c(F)cccc3[nH]2)CC1
459015,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459016,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459017,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,60.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459018,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459019,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,45.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459020,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,60.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459021,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459022,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,256.14554,[M-H]-,45.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459023,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,20.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459024,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,20.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459025,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,60.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459026,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,20.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459027,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,45.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459028,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,60.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459029,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,20.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459030,N#Cc1c(N2CCCC2C2CCCOC2)nccc1,258.16009,[M+H]+,45.0,val,N#Cc1cccnc1N1CCCC1C1CCCOC1
459031,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459032,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459033,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,30.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459034,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,60.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459035,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459036,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,45.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459037,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,60.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459038,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12,258.16009,[M+H]+,20.0,val,Cc1cccn2c(NC(=O)C(C)C3CCC3)cnc12
459039,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,20.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459040,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,20.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459041,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,60.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459042,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,30.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459043,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,20.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459044,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,60.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459045,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,30.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459046,OC1CCN(Cc2nn(-c3ccccc3)cc2)CC1,258.16009,[M+H]+,20.0,val,OC1CCN(Cc2ccn(-c3ccccc3)n2)CC1
459047,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,20.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459048,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,20.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459049,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,60.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459050,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,30.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459051,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,20.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459052,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,60.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459053,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,30.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459054,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C,258.16009,[M+H]+,20.0,val,CN(C(=O)C1CCCC1)c1nc2ccccc2n1C
459055,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,20.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459056,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,20.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459057,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,60.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459058,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,20.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459059,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,60.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459060,CC1CCCN(C(=O)c2c3c(ccc2)ncn3C)C1,258.16009,[M+H]+,20.0,val,CC1CCCN(C(=O)c2cccc3ncn(C)c23)C1
459061,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,20.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459062,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,20.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459063,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,60.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459064,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,30.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459065,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,20.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459066,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,60.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459067,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,30.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459068,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1,258.16009,[M+H]+,20.0,val,COc1ccc(-c2nc(C)nn2C2CCCC2)cc1
459069,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,20.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459070,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,20.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459071,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,60.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459072,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,30.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459073,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,20.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459074,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,60.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459075,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,30.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459076,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1,258.16009,[M+H]+,20.0,val,c1ccc(CNc2nnc(CC3CCCC3)o2)cc1
459077,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,20.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459078,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,20.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459079,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,60.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459080,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,30.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459081,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,20.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459082,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,60.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459083,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,30.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459084,CC(C(=O)N1c2c(cncc2)N2CCC1C2)C1CC1,258.16009,[M+H]+,20.0,val,CC(C(=O)N1c2ccncc2N2CCC1C2)C1CC1
459085,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,20.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459086,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,20.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459087,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,60.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459088,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,30.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459089,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,20.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459090,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,60.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459091,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,30.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459092,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C,258.16009,[M+H]+,20.0,val,CC(=O)NCc1cn(-c2ccccc2)nc1C(C)C
459093,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459094,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459095,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,60.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459096,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,30.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459097,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459098,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459099,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459100,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,60.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459101,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,15.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459102,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459103,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,366.11291,[M+FA]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459104,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,366.11291,[M+FA]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459105,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,366.11291,[M+FA]-,60.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459106,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,366.11291,[M+FA]-,15.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459107,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,366.11291,[M+FA]-,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459108,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459109,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459110,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459111,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,30.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459112,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459113,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,45.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459114,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459115,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,320.10744,[M-H]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459116,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,366.11291,[M+FA]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459117,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,366.11291,[M+FA]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459118,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,366.11291,[M+FA]-,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459119,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,366.11291,[M+FA]-,15.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459120,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,366.11291,[M+FA]-,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459121,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459122,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459123,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,60.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459124,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459125,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,45.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459126,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,60.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459127,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459128,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,320.10744,[M-H]-,45.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459129,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,356.08411,[M+Cl]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459130,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,356.08411,[M+Cl]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459131,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,356.08411,[M+Cl]-,60.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459132,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,356.08411,[M+Cl]-,15.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459133,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,356.08411,[M+Cl]-,20.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459134,Cc1noc2c1cc(S(=O)(=O)NCCC1=CCCCC1)cn2,366.11291,[M+FA]-,15.0,val,Cc1noc2ncc(S(=O)(=O)NCCC3=CCCCC3)cc12
459135,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459136,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459137,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,60.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459138,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,30.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459139,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,320.10744,[M-H]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459140,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459141,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459142,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,60.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459143,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,15.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459144,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,356.08411,[M+Cl]-,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459145,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459146,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459147,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,60.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459148,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,30.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459149,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459150,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,60.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459151,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,30.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459152,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,320.10744,[M-H]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459153,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,366.11291,[M+FA]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459154,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,366.11291,[M+FA]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459155,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,366.11291,[M+FA]-,60.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459156,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,366.11291,[M+FA]-,15.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459157,N#Cc1cc(NCCO)c(S(=O)(=O)N2CCCC3CC32)cc1,366.11291,[M+FA]-,20.0,val,N#Cc1ccc(S(=O)(=O)N2CCCC3CC32)c(NCCO)c1
459158,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,320.10744,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459159,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,320.10744,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459160,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,320.10744,[M-H]-,60.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459161,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,320.10744,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459162,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,320.10744,[M-H]-,45.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459163,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,20.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459164,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,20.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459165,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,60.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459166,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,30.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459167,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,20.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459168,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,60.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459169,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,30.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459170,Cc1c(C)c(N(C)S(=O)(=O)c2c3OCCCn3nc2)ccc1,322.12199,[M+H]+,20.0,val,Cc1cccc(N(C)S(=O)(=O)c2cnn3c2OCCC3)c1C
459171,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459172,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459173,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,60.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459174,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,30.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459175,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459176,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,60.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459177,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,30.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459178,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459179,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,344.10393,[M+Na]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459180,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,344.10393,[M+Na]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459181,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,344.10393,[M+Na]+,30.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459182,CN(c1nn(C)cc1)S(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,344.10393,[M+Na]+,20.0,val,CN(c1ccn(C)n1)S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459183,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,304.11143,[M+H-H2O]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459184,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,304.11143,[M+H-H2O]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459185,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,304.11143,[M+H-H2O]+,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459186,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,304.11143,[M+H-H2O]+,15.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459187,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,304.11143,[M+H-H2O]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459188,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459189,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459190,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,15.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459191,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459192,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,30.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459193,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459194,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,60.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459195,O=C(Cn1cnc2c(ccs2)c1=O)NCC1(O)CCCCC1,322.12199,[M+H]+,20.0,val,O=C(Cn1cnc2sccc2c1=O)NCC1(O)CCCCC1
459196,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459197,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459198,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,60.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459199,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,15.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459200,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,NS(=O)(=O)CC1CCCN(C(=O)c2cc3ccccc3[nH]2)C1
459201,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,20.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459202,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,20.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459203,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,60.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459204,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,30.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459205,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,20.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459206,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,60.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459207,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,30.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459208,CC1Cc2c(ccc(S(=O)(=O)N(C)Cc3cn(C)nc3)c2)O1,322.12199,[M+H]+,20.0,val,CC1Cc2cc(S(=O)(=O)N(C)Cc3cnn(C)c3)ccc2O1
459209,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1
459210,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1
459211,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1,322.12199,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1
459212,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1
459213,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1,322.12199,[M+H]+,45.0,val,CS(=O)(=O)c1ccc(-c2noc(CCC3CCNC3)n2)cc1
459214,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459215,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459216,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459217,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459218,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,45.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459219,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459220,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459221,Cc1n[nH]c(C)c1NS(=O)(=O)c1cc2c(cc1)OC(C)(C)C2,322.12199,[M+H]+,45.0,val,Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2
459222,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459223,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459224,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,60.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459225,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,30.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459226,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459227,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,60.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459228,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,30.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459229,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1,322.12199,[M+H]+,20.0,val,CS(=O)(=O)N1CCCC(NC(=O)c2cc3ccccc3[nH]2)C1
459230,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459231,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459232,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,60.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459233,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,30.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459234,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459235,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,60.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459236,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,30.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459237,Cc1noc(C2CCCN(Cc3c(C)sc(C(=O)O)c3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(C2CCCN(Cc3cc(C(=O)O)sc3C)C2)n1
459238,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,20.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459239,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,20.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459240,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,30.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459241,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,60.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459242,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,15.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459243,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,20.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459244,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,60.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459245,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1,322.12199,[M+H]+,20.0,val,Cc1cc(C)cc(-c2noc(CC3CNCCS3(=O)=O)n2)c1
459246,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459247,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459248,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459249,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459250,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459251,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459252,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459253,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,320.10744,[M-H]-,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459254,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,356.08411,[M+Cl]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459255,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,356.08411,[M+Cl]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459256,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,356.08411,[M+Cl]-,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459257,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,356.08411,[M+Cl]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459258,CCOC(=O)c1c2nnn(C3CCCCC3)c(=O)c2c(C)s1,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459259,CCOC(=O)c1c2nnn(C3CCCCC3)c(=O)c2c(C)s1,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459260,CCOC(=O)c1c2nnn(C3CCCCC3)c(=O)c2c(C)s1,322.12199,[M+H]+,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459261,CCOC(=O)c1c2nnn(C3CCCCC3)c(=O)c2c(C)s1,322.12199,[M+H]+,30.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459262,CCOC(=O)c1c2nnn(C3CCCCC3)c(=O)c2c(C)s1,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459263,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459264,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459265,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,322.12199,[M+H]+,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459266,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459267,CCCS(=O)(=O)Nc1cccc(-c2nnc(OCC)cc2)c1,322.12199,[M+H]+,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459268,CC[C@@H](C)[C@H](NC(=O)c1c(C)nc(-n2cccc2)s1)C(=O)O,320.10744,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O
459269,CC[C@@H](C)[C@H](NC(=O)c1c(C)nc(-n2cccc2)s1)C(=O)O,320.10744,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O
459270,CC[C@@H](C)[C@H](NC(=O)c1c(C)nc(-n2cccc2)s1)C(=O)O,320.10744,[M-H]-,60.0,val,CC[C@@H](C)[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O
459271,CC[C@@H](C)[C@H](NC(=O)c1c(C)nc(-n2cccc2)s1)C(=O)O,320.10744,[M-H]-,30.0,val,CC[C@@H](C)[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O
459272,CC[C@@H](C)[C@H](NC(=O)c1c(C)nc(-n2cccc2)s1)C(=O)O,320.10744,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O
459273,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,320.10744,[M-H]-,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459274,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,320.10744,[M-H]-,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459275,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,320.10744,[M-H]-,20.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459276,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,320.10744,[M-H]-,60.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459277,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,320.10744,[M-H]-,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459278,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,322.12199,[M+H]+,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459279,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,322.12199,[M+H]+,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459280,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,322.12199,[M+H]+,60.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459281,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,322.12199,[M+H]+,20.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459282,Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)O)sc(-n2cccc2)n1,322.12199,[M+H]+,30.0,val,Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](CC(C)C)C(=O)O
459283,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459284,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459285,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,60.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459286,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,30.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459287,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459288,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,30.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459289,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459290,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,320.10744,[M-H]-,60.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459291,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459292,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459293,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459294,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459295,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459296,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459297,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459298,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,320.10744,[M-H]-,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459299,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459300,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459301,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,60.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459302,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,30.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459303,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459304,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,60.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459305,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,30.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459306,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C,322.12199,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)c2c(C)nn(C)c2C)sc(C)c1C
459307,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,304.11143,[M+H-H2O]+,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459308,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,304.11143,[M+H-H2O]+,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459309,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,304.11143,[M+H-H2O]+,60.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459310,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,304.11143,[M+H-H2O]+,30.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459311,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1,304.11143,[M+H-H2O]+,20.0,val,Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)C1CC1
459312,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,322.12199,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1
459313,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,322.12199,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1
459314,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,322.12199,[M+H]+,60.0,val,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1
459315,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,322.12199,[M+H]+,30.0,val,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1
459316,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,322.12199,[M+H]+,20.0,val,CCn1cc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1
459317,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,20.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459318,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,20.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459319,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,60.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459320,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,30.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459321,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,20.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459322,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,60.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459323,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,30.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459324,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1,322.12199,[M+H]+,20.0,val,COCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1
459325,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1,322.12199,[M+H]+,20.0,val,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1
459326,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1,322.12199,[M+H]+,20.0,val,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1
459327,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1,322.12199,[M+H]+,60.0,val,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1
459328,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1,322.12199,[M+H]+,30.0,val,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1
459329,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1,322.12199,[M+H]+,20.0,val,CC1CCN(C(=O)C2=NN(C)c3ccccc3S2(=O)=O)CC1
459330,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459331,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459332,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459333,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459334,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459335,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459336,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459337,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1,322.12199,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NCCCn2ncccc2=O)c(C)c1
459338,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459339,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459340,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459341,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459342,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459343,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,60.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459344,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,45.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459345,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1,322.12199,[M+H]+,20.0,val,CCCS(=O)(=O)Nc1cccc(-c2ccc(OCC)nn2)c1
459346,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459347,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459348,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12,322.12199,[M+H]+,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459349,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12,322.12199,[M+H]+,30.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459350,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12,322.12199,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(C3CCCCC3)nnc12
459351,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,20.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459352,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,20.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459353,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,45.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459354,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,60.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459355,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,20.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459356,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,45.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459357,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,60.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459358,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1,322.12199,[M+H]+,20.0,val,CCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccc(C)cc1
459359,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C,322.12199,[M+H]+,20.0,val,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C
459360,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C,322.12199,[M+H]+,20.0,val,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C
459361,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C,322.12199,[M+H]+,60.0,val,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C
459362,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C,322.12199,[M+H]+,30.0,val,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C
459363,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C,322.12199,[M+H]+,20.0,val,CCOC(=O)c1c(NC(=O)c2ccnn2CC)sc(C)c1C
459364,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459365,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459366,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,45.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459367,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,60.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459368,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459369,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459370,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459371,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,60.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459372,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,30.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459373,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1,322.12199,[M+H]+,20.0,val,Cc1noc(COC2CCCN(C(=O)Cc3ccsc3)C2)n1
459374,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,328.13499,[M-H]-,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459375,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,328.13499,[M-H]-,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459376,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459377,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459378,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,30.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459379,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,60.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459380,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459381,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,45.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459382,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,60.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459383,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1,330.14954,[M+H]+,20.0,val,Cn1ccc(-c2nc(CN3CCC(c4ncn[nH]4)CC3)cs2)n1
459384,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459385,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459386,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,60.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459387,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,15.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459388,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459389,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,60.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459390,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,15.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459391,Cc1c(C(O)CNS(=O)(=O)CCc2ccccc2)scc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459392,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459393,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459394,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,60.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459395,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,15.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459396,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459397,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,15.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459398,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,20.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459399,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1,324.07336,[M-H]-,60.0,val,Cc1ccsc1C(O)CNS(=O)(=O)CCc1ccccc1
459400,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1,340.06827,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1
459401,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1,340.06827,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1
459402,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1,340.06827,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1
459403,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1,340.06827,[M-H]-,30.0,val,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1
459404,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1,340.06827,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1
459405,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1,342.08283,[M+H]+,20.0,val,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1
459406,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1,342.08283,[M+H]+,20.0,val,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1
459407,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1,342.08283,[M+H]+,60.0,val,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1
459408,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1,342.08283,[M+H]+,30.0,val,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1
459409,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1,342.08283,[M+H]+,20.0,val,CCOc1ccc(OCC)c(S(=O)(=O)NCc2cccs2)c1
459410,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O,324.09002,[M+H-H2O]+,20.0,val,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O
459411,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O,324.09002,[M+H-H2O]+,20.0,val,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O
459412,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O,324.09002,[M+H-H2O]+,45.0,val,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O
459413,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O,324.09002,[M+H-H2O]+,60.0,val,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O
459414,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O,324.09002,[M+H-H2O]+,20.0,val,CC(C)(C)OC(=O)N1Cc2cc(S(C)(=O)=O)ccc2[C@@H]1C(=O)O
459415,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459416,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459417,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,60.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459418,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,30.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459419,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459420,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459421,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,30.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459422,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,328.07797,[M-H]-,60.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459423,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,330.09252,[M+H]+,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459424,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,330.09252,[M+H]+,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459425,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,330.09252,[M+H]+,60.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459426,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,330.09252,[M+H]+,15.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459427,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1,330.09252,[M+H]+,20.0,val,CC(=O)N(CC(=O)O)CC1(c2ccc(Cl)s2)CCCCC1
459428,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,297.14201,[M-H]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459429,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,297.14201,[M-H]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459430,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,297.14201,[M-H]-,60.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459431,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,297.14201,[M-H]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459432,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,297.14201,[M-H]-,45.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459433,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,333.11869,[M+Cl]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459434,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,333.11869,[M+Cl]-,15.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459435,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,333.11869,[M+Cl]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459436,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459437,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459438,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,60.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459439,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,15.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459440,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459441,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,60.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459442,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,15.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459443,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,343.14749,[M+FA]-,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459444,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,299.15656,[M+H]+,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459445,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,299.15656,[M+H]+,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459446,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,299.15656,[M+H]+,60.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459447,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,299.15656,[M+H]+,15.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459448,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1,299.15656,[M+H]+,20.0,val,CC1(C)OCCC1NC(=O)NCc1ccc(C(F)F)cc1
459449,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459450,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459451,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,60.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459452,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,30.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459453,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459454,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459455,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459456,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,60.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459457,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,30.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459458,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1,342.12822,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CC2)CCN1S(=O)(=O)c1cncc(F)c1
459459,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1,342.12822,[M+H]+,30.0,val,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1
459460,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1,342.12822,[M+H]+,30.0,val,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1
459461,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1,342.12822,[M+H]+,20.0,val,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1
459462,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1,342.12822,[M+H]+,60.0,val,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1
459463,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1,342.12822,[M+H]+,30.0,val,O=C(C1CCCN1S(=O)(=O)c1ccccc1F)N1CCNCC1
459464,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459465,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459466,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,60.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459467,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,30.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459468,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459469,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459470,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,30.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459471,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O,342.12822,[M+H]+,60.0,val,CN1c2ccc(F)cc2N(CCNC(=O)C2CCCC2)S1(=O)=O
459472,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459473,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459474,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,45.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459475,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,60.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459476,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459477,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,45.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459478,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,60.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459479,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,323.10983,[M-H2O]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459480,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459481,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459482,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,60.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459483,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,30.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459484,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459485,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,60.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459486,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,30.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459487,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O,342.12822,[M+H]+,20.0,val,CN1c2ccc(F)cc2N(CC(=O)NC2CCCCC2)S1(=O)=O
459488,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F,313.11479,[M]+,30.0,val,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F
459489,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F,313.11479,[M]+,30.0,val,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F
459490,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F,313.11479,[M]+,20.0,val,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F
459491,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F,313.11479,[M]+,60.0,val,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F
459492,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F,313.11479,[M]+,30.0,val,COc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1F
459493,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459494,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459495,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,60.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459496,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,30.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459497,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459498,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,60.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459499,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,30.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459500,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,307.11219,[M-H]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459501,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,343.08886,[M+Cl]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459502,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,343.08886,[M+Cl]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459503,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,343.08886,[M+Cl]-,60.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459504,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,343.08886,[M+Cl]-,15.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459505,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,343.08886,[M+Cl]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459506,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,353.11767,[M+FA]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459507,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,353.11767,[M+FA]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459508,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,353.11767,[M+FA]-,60.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459509,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,353.11767,[M+FA]-,15.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459510,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,353.11767,[M+FA]-,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459511,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459512,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459513,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,60.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459514,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,15.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459515,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459516,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,60.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459517,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,15.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459518,Cc1c(S(=O)(=O)Nc2c(C)onc2)cc(C(C)(C)C)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cnoc1C
459519,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,309.12674,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459520,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,309.12674,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459521,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,309.12674,[M+H]+,60.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459522,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,309.12674,[M+H]+,30.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459523,Cc1cc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)ccc1,309.12674,[M+H]+,20.0,val,Cc1cccc(C2(C(=O)N3CCC(S(N)(=O)=O)C3)CC2)c1
459524,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,307.11219,[M-H]-,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459525,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,307.11219,[M-H]-,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459526,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,307.11219,[M-H]-,60.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459527,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,307.11219,[M-H]-,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459528,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,307.11219,[M-H]-,45.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459529,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459530,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459531,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,60.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459532,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,30.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459533,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459534,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,353.11767,[M+FA]-,60.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459535,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,353.11767,[M+FA]-,15.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459536,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,353.11767,[M+FA]-,20.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459537,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,307.11219,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459538,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,307.11219,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459539,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,307.11219,[M-H]-,60.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459540,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,307.11219,[M-H]-,60.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459541,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21,307.11219,[M-H]-,20.0,val,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21
459542,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21,307.11219,[M-H]-,20.0,val,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21
459543,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21,307.11219,[M-H]-,45.0,val,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21
459544,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21,307.11219,[M-H]-,60.0,val,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21
459545,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21,307.11219,[M-H]-,20.0,val,CN1C(=O)Cc2cc(NS(=O)(=O)C3CCCCC3)ccc21
459546,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459547,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459548,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,60.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459549,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,30.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459550,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459551,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459552,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,60.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459553,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,307.11219,[M-H]-,30.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459554,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,353.11767,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459555,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,353.11767,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459556,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,353.11767,[M+FA]-,60.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459557,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,353.11767,[M+FA]-,15.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459558,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,353.11767,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459559,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459560,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459561,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,60.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459562,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,15.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459563,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459564,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,45.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459565,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,60.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459566,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1,309.12674,[M+H]+,20.0,val,O=S(=O)(c1ccc2c(c1)CCO2)N1CC(N2CCCC2)C1
459567,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459568,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459569,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,15.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459570,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,60.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459571,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,30.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459572,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459573,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459574,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1,309.12674,[M+H]+,60.0,val,CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1
459575,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,20.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459576,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,20.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459577,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,60.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459578,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,30.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459579,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,20.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459580,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,30.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459581,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,60.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459582,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O,309.12674,[M+H]+,20.0,val,CN(C)CCCOC(=O)CC1Sc2ccccc2NC1=O
459583,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,20.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459584,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,20.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459585,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,60.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459586,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,30.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459587,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,20.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459588,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,30.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459589,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,20.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459590,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O,309.12674,[M+H]+,60.0,val,CCCn1ccc2sc(C)c(C(=O)NCCOC)c2c1=O
459591,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,20.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459592,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,20.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459593,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,60.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459594,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,30.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459595,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,20.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459596,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,60.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459597,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,30.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459598,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C,309.12674,[M+H]+,20.0,val,COCCN(Cc1ccsc1)C(=O)Cc1c(C)noc1C
459599,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459600,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459601,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,60.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459602,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,30.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459603,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459604,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,30.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459605,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459606,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2,309.12674,[M+H]+,60.0,val,CC1(C)C2CCC1(CS(=O)(=O)Nc1ccccn1)C(=O)C2
459607,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459608,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459609,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,60.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459610,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,30.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459611,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459612,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,60.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459613,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,20.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459614,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1,309.12674,[M+H]+,30.0,val,Cc1ccc(NC(=O)CSCC(=O)N2CCOCC2)cc1
459615,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,20.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459616,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,20.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459617,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,60.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459618,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,30.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459619,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,20.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459620,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,45.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459621,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,60.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459622,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1,309.12674,[M+H]+,20.0,val,O=C(c1cccnc1)N1CC(S(=O)(=O)C2CCCCC2)C1
459623,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,287.15135,[M-H]-,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459624,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,287.15135,[M-H]-,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459625,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,287.15135,[M-H]-,60.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459626,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,287.15135,[M-H]-,30.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459627,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,287.15135,[M-H]-,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459628,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459629,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459630,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,60.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459631,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,15.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459632,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459633,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,60.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459634,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,15.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459635,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,333.15683,[M+FA]-,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459636,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459637,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459638,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,60.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459639,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459640,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,45.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459641,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,60.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459642,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459643,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,287.15135,[M-H]-,45.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459644,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,323.12803,[M+Cl]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459645,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,323.12803,[M+Cl]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459646,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,323.12803,[M+Cl]-,60.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459647,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,323.12803,[M+Cl]-,15.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459648,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,323.12803,[M+Cl]-,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459649,Cn1nnc2c1ccc(C(=O)NC1CCOC(C)(C)C1)c2,289.1659,[M+H]+,20.0,val,Cn1nnc2cc(C(=O)NC3CCOC(C)(C)C3)ccc21
459650,Cn1nnc2c1ccc(C(=O)NC1CCOC(C)(C)C1)c2,289.1659,[M+H]+,20.0,val,Cn1nnc2cc(C(=O)NC3CCOC(C)(C)C3)ccc21
459651,Cn1nnc2c1ccc(C(=O)NC1CCOC(C)(C)C1)c2,289.1659,[M+H]+,60.0,val,Cn1nnc2cc(C(=O)NC3CCOC(C)(C)C3)ccc21
459652,Cn1nnc2c1ccc(C(=O)NC1CCOC(C)(C)C1)c2,289.1659,[M+H]+,30.0,val,Cn1nnc2cc(C(=O)NC3CCOC(C)(C)C3)ccc21
459653,Cn1nnc2c1ccc(C(=O)NC1CCOC(C)(C)C1)c2,289.1659,[M+H]+,20.0,val,Cn1nnc2cc(C(=O)NC3CCOC(C)(C)C3)ccc21
459654,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,20.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459655,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,20.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459656,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,60.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459657,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,20.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459658,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,45.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459659,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,60.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459660,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,20.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459661,COc1c(N(C)C(=O)c2cc(C(C)C)nn2C)nccc1,289.1659,[M+H]+,45.0,val,COc1cccnc1N(C)C(=O)c1cc(C(C)C)nn1C
459662,CN(C)c1ncc(C(=O)N2CCN(C3CC3)C(=O)C2)cc1,289.1659,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)N2CCN(C3CC3)C(=O)C2)cn1
459663,CN(C)c1ncc(C(=O)N2CCN(C3CC3)C(=O)C2)cc1,289.1659,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)N2CCN(C3CC3)C(=O)C2)cn1
459664,CN(C)c1ncc(C(=O)N2CCN(C3CC3)C(=O)C2)cc1,289.1659,[M+H]+,60.0,val,CN(C)c1ccc(C(=O)N2CCN(C3CC3)C(=O)C2)cn1
459665,CN(C)c1ncc(C(=O)N2CCN(C3CC3)C(=O)C2)cc1,289.1659,[M+H]+,30.0,val,CN(C)c1ccc(C(=O)N2CCN(C3CC3)C(=O)C2)cn1
459666,CN(C)c1ncc(C(=O)N2CCN(C3CC3)C(=O)C2)cc1,289.1659,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)N2CCN(C3CC3)C(=O)C2)cn1
459667,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,20.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459668,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,20.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459669,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,60.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459670,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,30.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459671,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,20.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459672,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,60.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459673,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,30.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459674,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21,289.1659,[M+H]+,20.0,val,Cn1c(CNC(=O)CN2CCOCC2)nc2ccccc21
459675,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459676,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459677,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,60.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459678,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,30.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459679,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459680,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,60.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459681,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,30.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459682,CCc1c(C)cc(C(=O)N(C)CCn2cccn2)c(=O)[nH]1,289.1659,[M+H]+,20.0,val,CCc1[nH]c(=O)c(C(=O)N(C)CCn2cccn2)cc1C
459683,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,20.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459684,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,20.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459685,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,60.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459686,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,30.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459687,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,20.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459688,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,60.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459689,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,30.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459690,CC1COCCN1CCNC(=O)c1cn2ccccc2n1,289.1659,[M+H]+,20.0,val,CC1COCCN1CCNC(=O)c1cn2ccccc2n1
459691,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,271.15534,[M+H-H2O]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459692,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,271.15534,[M+H-H2O]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459693,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,271.15534,[M+H-H2O]+,60.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459694,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,271.15534,[M+H-H2O]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459695,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,271.15534,[M+H-H2O]+,60.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459696,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459697,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459698,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,30.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459699,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,60.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459700,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,15.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459701,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459702,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,60.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459703,CNCCN(C)C(=O)c1c(-c2ccc(OC)cc2)[nH]nc1,289.1659,[M+H]+,20.0,val,CNCCN(C)C(=O)c1cn[nH]c1-c1ccc(OC)cc1
459704,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459705,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459706,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,30.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459707,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,60.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459708,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,15.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459709,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459710,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,60.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459711,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1,289.1659,[M+H]+,20.0,val,CNC(=O)NC1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1
459712,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,289.1659,[M+H]+,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459713,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,289.1659,[M+H]+,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459714,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,289.1659,[M+H]+,60.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459715,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,289.1659,[M+H]+,20.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459716,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12,289.1659,[M+H]+,45.0,val,Cc1nnc2ccc(C(=O)NC3CCOC(C)(C)C3)cn12
459717,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1,289.1659,[M+H]+,20.0,val,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1
459718,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1,289.1659,[M+H]+,20.0,val,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1
459719,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1,289.1659,[M+H]+,60.0,val,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1
459720,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1,289.1659,[M+H]+,15.0,val,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1
459721,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1,289.1659,[M+H]+,20.0,val,O=C1NCCN1Cc1ccccc1NC(=O)N1CCCC1
459722,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,287.15135,[M-H]-,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459723,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,287.15135,[M-H]-,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459724,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,287.15135,[M-H]-,60.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459725,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,287.15135,[M-H]-,30.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459726,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,287.15135,[M-H]-,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459727,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459728,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459729,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,60.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459730,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,30.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459731,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459732,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,60.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459733,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,30.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459734,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1,289.1659,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc(-c2ccccn2)n[nH]1
459735,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459736,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459737,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459738,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459739,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459740,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459741,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459742,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1,289.1659,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nccn3C)CC2)c(C)o1
459743,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,20.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459744,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,20.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459745,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,60.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459746,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,30.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459747,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,20.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459748,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,45.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459749,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,60.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459750,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21,333.16697,[M+H]+,20.0,val,Cn1cnc2c(N3CCOC(C(=O)N4CCOCC4)C3)ncnc21
459751,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,231.13796,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459752,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,231.13796,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459753,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,231.13796,[M+H-H2O]+,60.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459754,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,231.13796,[M+H-H2O]+,30.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459755,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,231.13796,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459756,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,249.14852,[M+H]+,20.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459757,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,249.14852,[M+H]+,20.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
459758,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31,249.14852,[M+H]+,60.0,val,C=C1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@@H]31
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459898,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,20.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459899,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,20.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459900,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,60.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459901,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,30.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459902,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,20.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459903,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,30.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459904,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,60.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459905,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1,341.08592,[M+H]+,20.0,val,CC(CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1
459906,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459907,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459908,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,60.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459909,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,30.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459910,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459911,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,60.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459912,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,30.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459913,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,343.11333,[M-H]-,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459914,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459915,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459916,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,30.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459917,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,60.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459918,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,15.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459919,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459920,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,60.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459921,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1,345.12788,[M+H]+,20.0,val,CC1CN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)CCO1
459922,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,306.14593,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459923,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,306.14593,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459924,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,306.14593,[M-H]-,60.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459925,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,306.14593,[M-H]-,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459926,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,306.14593,[M-H]-,45.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459927,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,352.15141,[M+FA]-,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459928,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,352.15141,[M+FA]-,60.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459929,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,352.15141,[M+FA]-,15.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459930,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,352.15141,[M+FA]-,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459931,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459932,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459933,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,60.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459934,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459935,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,45.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459936,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,60.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459937,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,20.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459938,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1,308.16048,[M+H]+,45.0,val,O=C(O)CC1(NC(=O)C2CCc3cncn3C2)CCCOC1
459939,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459940,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459941,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,30.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459942,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,60.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459943,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,15.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459944,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459945,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,60.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459946,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O,308.16048,[M+H]+,20.0,val,CN(C)[C@H]1CN(C(=O)c2ccc(OCC(N)=O)cc2)C[C@@H]1O
459947,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,306.14593,[M-H]-,30.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459948,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,306.14593,[M-H]-,30.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459949,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,306.14593,[M-H]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459950,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,306.14593,[M-H]-,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459951,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,306.14593,[M-H]-,30.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459952,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459953,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459954,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,352.15141,[M+FA]-,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459955,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,352.15141,[M+FA]-,15.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459956,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459957,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459958,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459959,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,60.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459960,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,30.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459961,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459962,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459963,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459964,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459965,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459966,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459967,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459968,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459969,COc1cn2CCN(CCNC(=O)C(C)C)C(=O)c2cc1=O,308.16048,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459970,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459971,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459972,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,352.15141,[M+FA]-,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459973,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,352.15141,[M+FA]-,15.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459974,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,352.15141,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459975,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1,308.16048,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1
459976,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1,308.16048,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1
459977,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1,308.16048,[M+H]+,60.0,val,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1
459978,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1,308.16048,[M+H]+,15.0,val,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1
459979,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1,308.16048,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc(C3CC3)on2)CC1
459980,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,20.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459981,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,20.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459982,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,60.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459983,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,30.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459984,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,20.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459985,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,30.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459986,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,60.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459987,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1,308.16048,[M+H]+,20.0,val,COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2=O)ccn1
459988,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459989,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459990,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,60.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459991,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,30.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459992,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459993,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,30.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459994,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,20.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459995,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O,308.16048,[M+H]+,60.0,val,CCOCCn1c(=O)c2c(OCC)c(C)cnc2n(C)c1=O
459996,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459997,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459998,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
459999,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
460000,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
460001,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
460002,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
460003,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2,308.16048,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)C(C)C)CC2
460004,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,354.11292,[M-H]-,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460005,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,354.11292,[M-H]-,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460006,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,354.11292,[M-H]-,60.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460007,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,354.11292,[M-H]-,30.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460008,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,354.11292,[M-H]-,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460009,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,354.11292,[M-H]-,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460010,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,354.11292,[M-H]-,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460011,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,354.11292,[M-H]-,60.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460012,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,354.11292,[M-H]-,30.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460013,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,354.11292,[M-H]-,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460014,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,356.12747,[M+H]+,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460015,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,356.12747,[M+H]+,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460016,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,356.12747,[M+H]+,60.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460017,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,356.12747,[M+H]+,20.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460018,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1,356.12747,[M+H]+,45.0,val,CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)CC1
460019,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460020,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460021,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,60.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460022,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,30.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460023,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460024,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,60.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460025,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,30.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460026,CCCC(C)c1cc(NS(=O)(=O)c2c(C)oc(C(=O)OC)c2)n[nH]1,356.12747,[M+H]+,20.0,val,CCCC(C)c1cc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)n[nH]1
460027,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460028,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460029,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,60.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460030,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,30.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460031,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460032,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,60.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460033,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,30.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460034,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,334.13432,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460035,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,370.111,[M+Cl]-,30.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460036,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,380.1398,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460037,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,380.1398,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460038,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,380.1398,[M+FA]-,60.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460039,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,380.1398,[M+FA]-,15.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460040,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,380.1398,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460041,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,334.13432,[M-H]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460042,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,334.13432,[M-H]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460043,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,334.13432,[M-H]-,60.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460044,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,334.13432,[M-H]-,30.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460045,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,334.13432,[M-H]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460046,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,380.1398,[M+FA]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460047,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,380.1398,[M+FA]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460048,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,380.1398,[M+FA]-,60.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460049,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,380.1398,[M+FA]-,15.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460050,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,380.1398,[M+FA]-,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460051,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460052,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460053,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,60.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460054,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460055,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,60.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460056,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1,336.14887,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2nn3cc(C4CCCC4)nc3s2)CC1
460057,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,20.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460058,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,20.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460059,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,60.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460060,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,20.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460061,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,45.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460062,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,60.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460063,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,20.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460064,Cc1cc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)ncc1,336.14887,[M+H]+,45.0,val,Cc1ccnc(N2CCN(S(=O)(=O)c3c(C)cnn3C)CC2)c1
460065,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460066,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460067,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,60.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460068,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,30.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460069,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460070,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,60.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460071,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,30.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460072,CNC(=O)CN1CCC(NC(=O)c2c(C)n3ccnc3s2)CC1,336.14887,[M+H]+,20.0,val,CNC(=O)CN1CCC(NC(=O)c2sc3nccn3c2C)CC1
460073,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,334.13432,[M-H]-,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460074,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,334.13432,[M-H]-,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460075,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,334.13432,[M-H]-,45.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460076,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,334.13432,[M-H]-,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460077,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,334.13432,[M-H]-,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460078,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,334.13432,[M-H]-,45.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460079,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,334.13432,[M-H]-,60.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460080,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,334.13432,[M-H]-,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460081,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1,336.14887,[M+H]+,20.0,val,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1
460082,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1,336.14887,[M+H]+,20.0,val,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1
460083,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1,336.14887,[M+H]+,45.0,val,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1
460084,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1,336.14887,[M+H]+,60.0,val,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1
460085,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1,336.14887,[M+H]+,20.0,val,Cc1nc(N2CCC(N(C)S(C)(=O)=O)CC2)c2ccncc2n1
460086,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,20.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460087,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,20.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460088,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,45.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460089,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,60.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460090,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,20.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460091,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,60.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460092,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,45.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460093,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21,336.14887,[M+H]+,20.0,val,Cn1ccc2c(N3CCCC(NS(=O)(=O)C4CC4)C3)ncnc21
460094,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,20.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460095,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,20.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460096,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,30.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460097,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,60.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460098,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,15.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460099,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,20.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460100,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,60.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460101,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1,336.14887,[M+H]+,20.0,val,Cc1cnn(C2CC3CCC(C2)N3S(=O)(=O)c2cn(C)cn2)c1
460102,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460103,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460104,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,45.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460105,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460106,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460107,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,45.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460108,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460109,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1,336.14887,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CN(c2ccccn2)C1
460110,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460111,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460112,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,60.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460113,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460114,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,60.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460115,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21,336.14887,[M+H]+,20.0,val,Cn1c(N2CCCC(NS(=O)(=O)C3CC3)C2)nc2cccnc21
460116,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,336.14887,[M+H]+,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460117,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,336.14887,[M+H]+,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460118,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,336.14887,[M+H]+,45.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460119,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,336.14887,[M+H]+,60.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460120,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1,336.14887,[M+H]+,20.0,val,Cc1cc2ncnc(N3CC(CN(C)S(=O)(=O)C4CC4)C3)c2[nH]1
460121,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O,320.17172,[M+H]+,20.0,val,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O
460122,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O,320.17172,[M+H]+,20.0,val,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O
460123,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O,320.17172,[M+H]+,60.0,val,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O
460124,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O,320.17172,[M+H]+,15.0,val,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O
460125,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O,320.17172,[M+H]+,20.0,val,Cn1c(C2C(C3CC3)CCN2C(=O)N2CCCC2=O)n[nH]c1=O
460126,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,318.15716,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460127,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,318.15716,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460128,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,318.15716,[M-H]-,60.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460129,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,318.15716,[M-H]-,30.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460130,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,318.15716,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460131,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460132,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460133,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,60.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460134,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,15.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460135,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460136,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,60.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460137,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O,320.17172,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2n[nH]c(CC(C)C)n2)c(C)cc1=O
460138,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,20.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460139,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,20.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460140,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,60.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460141,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,30.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460142,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,20.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460143,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,30.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460144,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,60.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460145,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1,320.17172,[M+H]+,20.0,val,CC1CCN(C(=O)Cn2cnc3c(cnn3CCO)c2=O)CC1
460146,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460147,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460148,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,60.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460149,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,30.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460150,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460151,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,60.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460152,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,30.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460153,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,334.15208,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460154,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,370.12876,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460155,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,370.12876,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460156,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,370.12876,[M+Cl]-,60.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460157,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,370.12876,[M+Cl]-,15.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460158,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,370.12876,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460159,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460160,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460161,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,60.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460162,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,30.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460163,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460164,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,60.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460165,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,30.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460166,NC(=O)C1CN(C(=O)Nc2cnc(N3CCOCC3)cc2)CCO1,336.16663,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)Nc2ccc(N3CCOCC3)nc2)CCO1
460167,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O,336.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
460168,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O,336.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
460169,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O,336.16663,[M+H]+,60.0,val,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
460170,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O,336.16663,[M+H]+,30.0,val,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
460171,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O,336.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O
460172,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1,336.16663,[M+H]+,20.0,val,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1
460173,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1,336.16663,[M+H]+,20.0,val,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1
460174,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1,336.16663,[M+H]+,60.0,val,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1
460175,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1,336.16663,[M+H]+,30.0,val,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1
460176,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1,336.16663,[M+H]+,20.0,val,CC1CN(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC(C)O1
460177,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O,324.15856,[M+H]+,20.0,val,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O
460178,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O,324.15856,[M+H]+,20.0,val,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O
460179,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O,324.15856,[M+H]+,60.0,val,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O
460180,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O,324.15856,[M+H]+,30.0,val,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O
460181,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O,324.15856,[M+H]+,20.0,val,CN1CCC(N2CCC(N(C)c3ncc(Cl)cn3)CC2)C1=O
460182,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,20.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460183,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,20.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460184,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,60.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460185,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,30.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460186,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,20.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460187,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,60.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460188,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,30.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460189,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1,313.18344,[M+H]+,20.0,val,CCC(C)n1ncc(NC(=O)N2CCC(F)(F)C2)c1C1CC1
460190,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,342.12932,[M-H]-,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460191,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,342.12932,[M-H]-,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460192,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,342.12932,[M-H]-,60.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460193,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,342.12932,[M-H]-,30.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460194,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,342.12932,[M-H]-,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460195,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,344.14387,[M+H]+,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460196,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,344.14387,[M+H]+,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460197,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,344.14387,[M+H]+,60.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460198,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,344.14387,[M+H]+,30.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460199,CC1CC(NS(=O)(=O)c2c(NCC(=O)N(C)C)ccc(F)c2)C1,344.14387,[M+H]+,20.0,val,CC1CC(NS(=O)(=O)c2cc(F)ccc2NCC(=O)N(C)C)C1
460200,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,357.07707,[M-H]-,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460201,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,357.07707,[M-H]-,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460202,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,357.07707,[M-H]-,60.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460203,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,357.07707,[M-H]-,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460204,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,357.07707,[M-H]-,45.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460205,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,393.05374,[M+Cl]-,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460206,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,393.05374,[M+Cl]-,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460207,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460208,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460209,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,60.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460210,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460211,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,45.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460212,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,60.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460213,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460214,CCN(CC)S(=O)(=O)c1c(C)sc(-c2nc(C(C)C)cs2)c1,359.09162,[M+H]+,45.0,val,CCN(CC)S(=O)(=O)c1cc(-c2nc(C(C)C)cs2)sc1C
460215,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460216,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460217,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,60.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460218,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460219,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,60.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460220,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1,359.09162,[M+H]+,20.0,val,CC(C)CNS(=O)(=O)c1cc(-c2nc(CC(C)C)cs2)cs1
460221,CSCC1CCC(NC(=O)c2c(S(C)(=O)=O)cccn2)CC1,343.11446,[M+H]+,20.0,val,CSCC1CCC(NC(=O)c2ncccc2S(C)(=O)=O)CC1
460222,CSCC1CCC(NC(=O)c2c(S(C)(=O)=O)cccn2)CC1,343.11446,[M+H]+,20.0,val,CSCC1CCC(NC(=O)c2ncccc2S(C)(=O)=O)CC1
460223,CSCC1CCC(NC(=O)c2c(S(C)(=O)=O)cccn2)CC1,343.11446,[M+H]+,60.0,val,CSCC1CCC(NC(=O)c2ncccc2S(C)(=O)=O)CC1
460224,CSCC1CCC(NC(=O)c2c(S(C)(=O)=O)cccn2)CC1,343.11446,[M+H]+,30.0,val,CSCC1CCC(NC(=O)c2ncccc2S(C)(=O)=O)CC1
460225,CSCC1CCC(NC(=O)c2c(S(C)(=O)=O)cccn2)CC1,343.11446,[M+H]+,20.0,val,CSCC1CCC(NC(=O)c2ncccc2S(C)(=O)=O)CC1
460226,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,341.09991,[M-H]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460227,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,341.09991,[M-H]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460228,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,341.09991,[M-H]-,60.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460229,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,341.09991,[M-H]-,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460230,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,341.09991,[M-H]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460231,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460232,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460233,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,60.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460234,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460235,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460236,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460237,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460238,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,387.10539,[M+FA]-,60.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460239,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,325.1039,[M+H-H2O]+,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460240,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,325.1039,[M+H-H2O]+,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460241,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,325.1039,[M+H-H2O]+,60.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460242,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,325.1039,[M+H-H2O]+,30.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460243,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,325.1039,[M+H-H2O]+,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460244,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,343.11446,[M+H]+,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460245,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,343.11446,[M+H]+,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460246,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,343.11446,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460247,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,343.11446,[M+H]+,60.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460248,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1,343.11446,[M+H]+,15.0,val,CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1
460249,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,20.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460250,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,20.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460251,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,60.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460252,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,30.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460253,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,20.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460254,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,30.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460255,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,20.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460256,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O,343.11446,[M+H]+,60.0,val,CN(CC(=O)N1CCSC(c2ccccc2)CC1)S(C)(=O)=O
460257,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460258,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460259,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,60.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460260,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,30.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460261,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460262,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,60.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460263,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,30.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460264,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,317.17315,[M-H]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460265,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,353.14983,[M+Cl]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460266,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,353.14983,[M+Cl]-,15.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460267,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,353.14983,[M+Cl]-,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460268,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,319.1877,[M+H]+,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460269,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,319.1877,[M+H]+,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460270,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,319.1877,[M+H]+,60.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460271,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,319.1877,[M+H]+,15.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460272,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1,319.1877,[M+H]+,20.0,val,CC(C)c1cc(NC(=O)N2CCC(Cn3ccnn3)CC2)no1
460273,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,20.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460274,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,20.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460275,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,60.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460276,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,15.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460277,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,20.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460278,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,60.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460279,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,15.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460280,COc1nccnc1N(C)CC1CCN(Cc2nocn2)CC1,319.1877,[M+H]+,20.0,val,COc1nccnc1N(C)CC1CCN(Cc2ncon2)CC1
460281,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C,335.18261,[M+H]+,20.0,val,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C
460282,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C,335.18261,[M+H]+,20.0,val,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C
460283,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C,335.18261,[M+H]+,60.0,val,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C
460284,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C,335.18261,[M+H]+,15.0,val,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C
460285,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C,335.18261,[M+H]+,20.0,val,CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCNC(=O)C1)n2C
460286,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460287,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460288,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,45.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460289,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,60.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460290,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460291,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460292,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460293,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,60.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460294,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,30.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460295,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1,335.18261,[M+H]+,20.0,val,CN(C)c1nccnc1OC1CCCN(C(=O)N2CCNC2=O)C1
460296,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460297,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460298,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,45.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460299,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,60.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460300,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460301,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,45.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460302,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,60.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460303,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1,347.19385,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NCc2nc(N(C)C)nc(N(C)C)n2)cn1
460304,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,473.12086,[M-H]-,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460305,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,473.12086,[M-H]-,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460306,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,473.12086,[M-H]-,60.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460307,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,473.12086,[M-H]-,30.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460308,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,473.12086,[M-H]-,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460309,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,475.13541,[M+H]+,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460310,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,475.13541,[M+H]+,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460311,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,475.13541,[M+H]+,60.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460312,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,475.13541,[M+H]+,15.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460313,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,475.13541,[M+H]+,20.0,val,NC(=O)CC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
460314,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,352.16264,[M-H]-,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460315,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,352.16264,[M-H]-,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460316,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,352.16264,[M-H]-,60.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460317,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,352.16264,[M-H]-,30.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460318,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,352.16264,[M-H]-,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460319,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460320,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460321,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,60.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460322,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,30.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460323,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460324,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,60.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460325,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,30.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460326,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C,354.17719,[M+H]+,20.0,val,C=CCOCC(O)Cn1c(NCC(C)O)nc2c1c(=O)[nH]c(=O)n2C
460327,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,20.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460328,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,20.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460329,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,60.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460330,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,20.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460331,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,60.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460332,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2,233.20122,[M+H]+,20.0,val,C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2
460333,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,565.04774,[M-H]-,30.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460334,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,565.04774,[M-H]-,30.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460335,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,565.04774,[M-H]-,60.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460336,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,565.04774,[M-H]-,20.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460337,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,565.04774,[M-H]-,30.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460338,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,589.04424,[M+Na]+,20.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460339,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,589.04424,[M+Na]+,20.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460340,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,589.04424,[M+Na]+,60.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460341,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1,589.04424,[M+Na]+,20.0,val,O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
460342,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460343,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460344,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,45.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460345,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,60.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460346,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460347,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,60.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460348,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1,359.11047,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)CC(C)C)cc2C1
460349,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460350,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460351,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,60.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460352,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,30.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460353,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460354,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,60.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460355,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,30.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460356,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,307.17757,[M-H]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460357,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,343.15424,[M+Cl]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460358,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,343.15424,[M+Cl]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460359,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,343.15424,[M+Cl]-,15.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460360,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,343.15424,[M+Cl]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460361,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,353.18304,[M+FA]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460362,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,353.18304,[M+FA]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460363,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,353.18304,[M+FA]-,60.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460364,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,353.18304,[M+FA]-,15.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460365,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,353.18304,[M+FA]-,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460366,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460367,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460368,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460369,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460370,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460371,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460372,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460373,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,307.17757,[M-H]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460374,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,343.15424,[M+Cl]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460375,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,343.15424,[M+Cl]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460376,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,343.15424,[M+Cl]-,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460377,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,343.15424,[M+Cl]-,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460378,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,343.15424,[M+Cl]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460379,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,353.18304,[M+FA]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460380,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,353.18304,[M+FA]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460381,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,353.18304,[M+FA]-,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460382,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,353.18304,[M+FA]-,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460383,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,353.18304,[M+FA]-,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460384,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,353.18304,[M+FA]-,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460385,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,353.18304,[M+FA]-,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460386,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,353.18304,[M+FA]-,60.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460387,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,353.18304,[M+FA]-,15.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460388,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,353.18304,[M+FA]-,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460389,COCC1(O)CCN(C(=O)NC2CCc3c(cn[nH]3)C2)CC1,309.19212,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCc3[nH]ncc3C2)CC1
460390,COCC1(O)CCN(C(=O)NC2CCc3c(cn[nH]3)C2)CC1,309.19212,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCc3[nH]ncc3C2)CC1
460391,COCC1(O)CCN(C(=O)NC2CCc3c(cn[nH]3)C2)CC1,309.19212,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)NC2CCc3[nH]ncc3C2)CC1
460392,COCC1(O)CCN(C(=O)NC2CCc3c(cn[nH]3)C2)CC1,309.19212,[M+H]+,15.0,val,COCC1(O)CCN(C(=O)NC2CCc3[nH]ncc3C2)CC1
460393,COCC1(O)CCN(C(=O)NC2CCc3c(cn[nH]3)C2)CC1,309.19212,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCc3[nH]ncc3C2)CC1
460394,CCC(O)CN1CCN(C(=O)Nc2nc(OC)ccc2)CC1,309.19212,[M+H]+,20.0,val,CCC(O)CN1CCN(C(=O)Nc2cccc(OC)n2)CC1
460395,CCC(O)CN1CCN(C(=O)Nc2nc(OC)ccc2)CC1,309.19212,[M+H]+,20.0,val,CCC(O)CN1CCN(C(=O)Nc2cccc(OC)n2)CC1
460396,CCC(O)CN1CCN(C(=O)Nc2nc(OC)ccc2)CC1,309.19212,[M+H]+,60.0,val,CCC(O)CN1CCN(C(=O)Nc2cccc(OC)n2)CC1
460397,CCC(O)CN1CCN(C(=O)Nc2nc(OC)ccc2)CC1,309.19212,[M+H]+,15.0,val,CCC(O)CN1CCN(C(=O)Nc2cccc(OC)n2)CC1
460398,CCC(O)CN1CCN(C(=O)Nc2nc(OC)ccc2)CC1,309.19212,[M+H]+,20.0,val,CCC(O)CN1CCN(C(=O)Nc2cccc(OC)n2)CC1
460399,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,309.19212,[M+H]+,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460400,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,309.19212,[M+H]+,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460401,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,309.19212,[M+H]+,60.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460402,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,309.19212,[M+H]+,30.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460403,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1,309.19212,[M+H]+,20.0,val,CCNC(=O)N1CCCCC1c1nnc(C2CCOCC2)o1
460404,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,309.19212,[M+H]+,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460405,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,309.19212,[M+H]+,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460406,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,309.19212,[M+H]+,60.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460407,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,309.19212,[M+H]+,30.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460408,O=C(Nc1cn(CC2CCCO2)nc1)NC1CCC(O)CC1,309.19212,[M+H]+,20.0,val,O=C(Nc1cnn(CC2CCCO2)c1)NC1CCC(O)CC1
460409,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1,309.19212,[M+H]+,20.0,val,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1
460410,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1,309.19212,[M+H]+,20.0,val,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1
460411,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1,309.19212,[M+H]+,60.0,val,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1
460412,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1,309.19212,[M+H]+,20.0,val,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1
460413,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1,309.19212,[M+H]+,45.0,val,Cn1cncc1C1CCN(C(=O)NCC2COCCO2)CC1
460414,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460415,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460416,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,60.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460417,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,30.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460418,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460419,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,60.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460420,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,30.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460421,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,309.19212,[M+H]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460422,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,331.17406,[M+Na]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460423,COC1(C)CCCN(C(=O)Nc2nnc(OC(C)C)cc2)C1,331.17406,[M+Na]+,20.0,val,COC1(C)CCCN(C(=O)Nc2ccc(OC(C)C)nn2)C1
460424,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460425,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460426,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460427,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460428,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460429,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,20.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460430,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,60.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460431,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O,309.19212,[M+H]+,15.0,val,CC(C)(C)n1cc(CNC(=O)NCC2CCC2)c(=O)[nH]c1=O
460432,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460433,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460434,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,60.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460435,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,30.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460436,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460437,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460438,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,30.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460439,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1,309.19212,[M+H]+,60.0,val,Cc1cc(NC(=O)CN2CCN(CC(O)C3CC3)CC2)no1
460440,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460441,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460442,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,60.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460443,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,30.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460444,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460445,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,60.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460446,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,30.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460447,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,325.18703,[M+H]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460448,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,347.16897,[M+Na]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460449,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,347.16897,[M+Na]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460450,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,347.16897,[M+Na]+,60.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460451,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,347.16897,[M+Na]+,20.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460452,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2COCCn21,347.16897,[M+Na]+,45.0,val,COC(=O)c1c(NC(=O)NCCCC(C)C)nc2n1CCOC2
460453,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,323.17248,[M-H]-,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460454,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,323.17248,[M-H]-,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460455,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,323.17248,[M-H]-,60.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460456,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,323.17248,[M-H]-,15.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460457,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,323.17248,[M-H]-,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460458,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,325.18703,[M+H]+,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460459,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,325.18703,[M+H]+,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460460,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,325.18703,[M+H]+,60.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460461,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,325.18703,[M+H]+,15.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460462,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1,325.18703,[M+H]+,20.0,val,NC(=O)c1noc([C@H](CCCC2CCCCC2)CC(=O)NO)n1
460463,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460464,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460465,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,60.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460466,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,30.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460467,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460468,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,60.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460469,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,30.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460470,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460471,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1,325.18703,[M+H]+,20.0,val,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1
460472,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1,325.18703,[M+H]+,20.0,val,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1
460473,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1,325.18703,[M+H]+,60.0,val,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1
460474,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1,325.18703,[M+H]+,30.0,val,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1
460475,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1,325.18703,[M+H]+,20.0,val,COCCNC(=O)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1
460476,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460477,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460478,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,60.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460479,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,30.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460480,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460481,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460482,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460483,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,60.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460484,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,30.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460485,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460486,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,20.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460487,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,30.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460488,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2,325.18703,[M+H]+,60.0,val,CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2
460489,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O,287.1864,[M-H]-,30.0,val,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O
460490,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O,287.1864,[M-H]-,30.0,val,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O
460491,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O,287.1864,[M-H]-,60.0,val,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O
460492,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O,287.1864,[M-H]-,20.0,val,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O
460493,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O,287.1864,[M-H]-,30.0,val,CCCCCCCCCCC(C(=O)O)C(O)CC(=O)O
460494,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,312.22927,[M+FA]-,45.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460495,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,312.22927,[M+FA]-,20.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460496,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,312.22927,[M+FA]-,60.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460497,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,312.22927,[M+FA]-,45.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460498,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,20.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460499,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,20.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460500,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,30.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460501,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,60.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460502,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,15.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460503,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,20.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460504,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,60.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460505,CCC1CCCCC1NC(=O)NC1CCCC(N)C1,268.23834,[M+H]+,20.0,val,CCC1CCCCC1NC(=O)NC1CCCC(N)C1
460506,O=C(O)c1cc2c(C(=O)c3c(O)c(Cl)c(O)cc3C2=O)c(O)c1,332.98075,[M-H]-,60.0,val,O=C(O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(Cl)c(O)c1C2=O
460507,O=C(O)c1cc2c(C(=O)c3c(O)c(Cl)c(O)cc3C2=O)c(O)c1,332.98075,[M-H]-,60.0,val,O=C(O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(Cl)c(O)c1C2=O
460508,O=C(O)c1cc2c(C(=O)c3c(O)c(Cl)c(O)cc3C2=O)c(O)c1,332.98075,[M-H]-,20.0,val,O=C(O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(Cl)c(O)c1C2=O
460509,O=C(O)c1cc2c(C(=O)c3c(O)c(Cl)c(O)cc3C2=O)c(O)c1,332.98075,[M-H]-,60.0,val,O=C(O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(Cl)c(O)c1C2=O
460510,O=C(O)c1cc2c(C(=O)c3c(O)c(Cl)c(O)cc3C2=O)c(O)c1,332.98075,[M-H]-,60.0,val,O=C(O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(Cl)c(O)c1C2=O
460511,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460512,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460513,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460514,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460515,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,30.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460516,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460517,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460518,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,393.00709,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460519,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,428.98376,[M+Cl]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460520,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,428.98376,[M+Cl]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460521,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,428.98376,[M+Cl]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460522,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,428.98376,[M+Cl]-,60.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460523,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,428.98376,[M+Cl]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460524,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460525,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460526,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,60.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460527,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460528,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460529,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,60.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460530,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,15.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460531,O=C(Nc1cc2c(cc1)OC(F)(F)O2)Nc1cc(C(F)(F)F)c(Cl)cc1,439.01256,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)OC(F)(F)O2)Nc1ccc(Cl)c(C(F)(F)F)c1
460532,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460533,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460534,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,45.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460535,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,60.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460536,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460537,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460538,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,45.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460539,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,302.98882,[M-H]-,60.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460540,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,305.00337,[M+H]+,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460541,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,305.00337,[M+H]+,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460542,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,305.00337,[M+H]+,60.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460543,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,305.00337,[M+H]+,30.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460544,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1,305.00337,[M+H]+,20.0,val,O=c1oc2ccccc2c(O)c1Sc1ccc(Cl)cc1
460545,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1,323.0638,[M+H]+,30.0,val,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1
460546,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1,323.0638,[M+H]+,30.0,val,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1
460547,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1,323.0638,[M+H]+,20.0,val,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1
460548,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1,323.0638,[M+H]+,60.0,val,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1
460549,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1,323.0638,[M+H]+,30.0,val,O=c1oc2cccnc2c(=O)n1Cc1cccc(C(F)(F)F)c1
460550,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460551,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460552,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,45.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460553,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,60.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460554,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460555,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,45.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460556,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460557,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,321.03149,[M-H]-,60.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460558,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,323.04604,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460559,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,323.04604,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460560,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,323.04604,[M+H]+,60.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460561,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,323.04604,[M+H]+,30.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460562,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F,323.04604,[M+H]+,20.0,val,O=C(Nc1nc2ccccc2s1)c1ccccc1C(F)(F)F
460563,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,246.06729,[M-H]-,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460564,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,246.06729,[M-H]-,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460565,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,246.06729,[M-H]-,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460566,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,246.06729,[M-H]-,45.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460567,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,248.08184,[M+H]+,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460568,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,248.08184,[M+H]+,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460569,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,248.08184,[M+H]+,60.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460570,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,248.08184,[M+H]+,20.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460571,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12,248.08184,[M+H]+,45.0,val,O=Nc1c2[nH]c3ccccc3nc-2c2ccccc12
460572,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12,394.00908,[M+H]+,20.0,val,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12
460573,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12,394.00908,[M+H]+,20.0,val,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12
460574,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12,394.00908,[M+H]+,60.0,val,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12
460575,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12,394.00908,[M+H]+,20.0,val,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12
460576,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12,394.00908,[M+H]+,45.0,val,Cc1ccccc1Cc1nnc2sc(-c3cc(F)c(Cl)nc3Cl)nn12
460577,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2,329.03553,[M+H]+,20.0,val,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2
460578,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2,329.03553,[M+H]+,20.0,val,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2
460579,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2,329.03553,[M+H]+,45.0,val,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2
460580,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2,329.03553,[M+H]+,60.0,val,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2
460581,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2,329.03553,[M+H]+,20.0,val,Clc1ccc2c(c1)C(c1ccccc1Cl)=NCc1nncn1-2
460582,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460583,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460584,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,60.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460585,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,30.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460586,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460587,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,60.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460588,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,30.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460589,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,358.02634,[M-H]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460590,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,394.00302,[M+Cl]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460591,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,394.00302,[M+Cl]-,20.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460592,COc1c([C@]2(F)C(=O)Nc3c2ccc(C(F)(F)F)c3)cc(Cl)cc1,394.00302,[M+Cl]-,60.0,val,COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(C(F)(F)F)ccc21
460593,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460594,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460595,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,60.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460596,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,30.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460597,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460598,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460599,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,30.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460600,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,323.08623,[M-H]-,60.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460601,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460602,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460603,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,60.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460604,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,30.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460605,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460606,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,30.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460607,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,20.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460608,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1,325.10078,[M+H]+,60.0,val,Fc1cc(F)cc(-c2[nH]ncc2-c2nnnn2-c2ccccc2)c1
460609,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460610,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460611,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,60.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460612,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,30.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460613,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460614,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,60.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460615,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,30.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460616,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,349.0718,[M-H]-,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460617,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,385.04847,[M+Cl]-,15.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460618,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,385.04847,[M+Cl]-,15.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460619,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,385.04847,[M+Cl]-,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460620,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,385.04847,[M+Cl]-,60.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460621,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,385.04847,[M+Cl]-,15.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460622,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460623,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460624,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,60.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460625,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,30.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460626,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460627,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,60.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460628,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,30.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460629,O=C(Nc1ccncc1)c1c(C(F)(F)F)n(-c2ccccc2F)nc1,351.08635,[M+H]+,20.0,val,O=C(Nc1ccncc1)c1cnn(-c2ccccc2F)c1C(F)(F)F
460630,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,20.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460631,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,20.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460632,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,60.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460633,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,20.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460634,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,60.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460635,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1,439.01927,[M-H]-,20.0,val,O=C1COc2ccc(S(=O)(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1
460636,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,20.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460637,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,20.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460638,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,60.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460639,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,30.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460640,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,20.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460641,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,60.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460642,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,30.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460643,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2,496.03719,[M+H]+,20.0,val,Cc1nnc2n1-c1ccccc1C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=CC2
460644,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460645,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460646,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,45.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460647,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,60.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460648,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460649,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,45.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460650,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,60.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460651,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,281.04555,[M-H]-,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460652,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460653,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460654,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,45.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460655,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,60.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460656,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460657,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,60.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460658,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,45.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460659,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12,283.0601,[M+H]+,20.0,val,O=c1c(-c2ccc3c(c2)OCO3)coc2cc(O)ccc12
460660,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1,334.00432,[M-H]-,20.0,val,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1
460661,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1,334.00432,[M-H]-,20.0,val,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1
460662,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1,334.00432,[M-H]-,45.0,val,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1
460663,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1,334.00432,[M-H]-,20.0,val,O=C1CCC(=O)N1c1ccc(Oc2ccc(Cl)cc2Cl)cc1
460664,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1,336.01887,[M+H]+,20.0,val,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1
460665,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1,336.01887,[M+H]+,20.0,val,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1
460666,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1,336.01887,[M+H]+,60.0,val,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1
460667,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1,336.01887,[M+H]+,15.0,val,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1
460668,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1,336.01887,[M+H]+,20.0,val,O=C(NCc1ccco1)c1ccc(-c2ccc(Cl)c(Cl)c2)o1
460669,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460670,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460671,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460672,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,30.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460673,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460674,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460675,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,30.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460676,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2,439.0402,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(C(F)(F)F)(C(F)(F)F)N=C(c1ccc(Cl)cc1)N2
460677,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,20.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460678,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,20.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460679,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,60.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460680,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,20.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460681,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,60.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460682,CS(=O)(=O)c1cc2c(cc1)n1cc(-c3ccc(Cl)cc3)nc1s2,363.00232,[M+H]+,20.0,val,CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccc(Cl)cc3)cn12
460683,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1,343.04149,[M+H]+,20.0,val,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1
460684,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1,343.04149,[M+H]+,20.0,val,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1
460685,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1,343.04149,[M+H]+,60.0,val,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1
460686,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1,343.04149,[M+H]+,20.0,val,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1
460687,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1,343.04149,[M+H]+,45.0,val,Clc1cccc(CSc2nnc3ccc(-c4ccco4)nn23)c1
460688,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460689,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460690,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,60.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460691,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,30.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460692,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460693,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460694,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,30.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460695,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,321.0661,[M-H]-,60.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460696,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460697,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460698,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,60.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460699,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,30.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460700,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460701,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,30.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460702,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,20.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460703,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1,323.08065,[M+H]+,60.0,val,Clc1ccccc1-c1[nH]ncc1-c1nnnn1-c1ccccc1
460704,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,321.09056,[M-H]-,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460705,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,321.09056,[M-H]-,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460706,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,321.09056,[M-H]-,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460707,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,321.09056,[M-H]-,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460708,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,321.09056,[M-H]-,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460709,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460710,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460711,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460712,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460713,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460714,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460715,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460716,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460717,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460718,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460719,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460720,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460721,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460722,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460723,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460724,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460725,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460726,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460727,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460728,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460729,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460730,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,60.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460731,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,20.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460732,O=C(NNc1nc2c(ccc(F)c2)n2cccc12)c1nccnc1,323.10511,[M+H]+,45.0,val,O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1
460733,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,367.09604,[M+FA]-,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460734,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,367.09604,[M+FA]-,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460735,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,367.09604,[M+FA]-,60.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460736,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,367.09604,[M+FA]-,15.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460737,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,367.09604,[M+FA]-,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460738,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,323.10511,[M+H]+,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460739,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,323.10511,[M+H]+,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460740,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,323.10511,[M+H]+,60.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460741,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,323.10511,[M+H]+,30.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460742,O=c1c2c(ncn1Cc1cnccc1)n(-c1cc(F)ccc1)nn2,323.10511,[M+H]+,20.0,val,O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1cccnc1
460743,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460744,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460745,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,60.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460746,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,30.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460747,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460748,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460749,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460750,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,60.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460751,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,30.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460752,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460753,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,60.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460754,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,30.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460755,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1,326.04163,[M+H]+,20.0,val,c1ccc(-c2noc(Cc3nc(-c4cccs4)cs3)n2)cc1
460756,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2c1ccc(Cl)c2,319.03994,[M+H]+,20.0,val,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21
460757,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2c1ccc(Cl)c2,319.03994,[M+H]+,20.0,val,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21
460758,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2c1ccc(Cl)c2,319.03994,[M+H]+,60.0,val,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21
460759,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2c1ccc(Cl)c2,319.03994,[M+H]+,20.0,val,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21
460760,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2c1ccc(Cl)c2,319.03994,[M+H]+,45.0,val,CN1C(=O)CN=C(c2ccc(Cl)cc2)c2cc(Cl)ccc21
460761,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,20.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460762,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,20.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460763,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,45.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460764,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,60.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460765,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,20.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460766,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,45.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460767,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,60.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460768,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O,319.03994,[M+H]+,20.0,val,Cc1nc2ccccc2n(Cc2c(Cl)cccc2Cl)c1=O
460769,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1,319.03994,[M+H]+,45.0,val,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1
460770,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1,319.03994,[M+H]+,45.0,val,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1
460771,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1,319.03994,[M+H]+,45.0,val,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1
460772,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1,319.03994,[M+H]+,20.0,val,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1
460773,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1,319.03994,[M+H]+,60.0,val,Clc1ccc(-c2nnc(CCc3ccccc3)o2)c(Cl)c1
460774,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1
460775,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1
460776,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1,314.05132,[M+H]+,45.0,val,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1
460777,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1,314.05132,[M+H]+,60.0,val,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1
460778,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(CSc2ccc(-c3ccccn3)nn2)cc1
460779,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460780,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460781,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,45.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460782,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,60.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460783,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460784,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,20.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460785,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,45.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460786,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1,314.05132,[M+H]+,60.0,val,Clc1ccc(-c2ccc(SCc3cccnc3)nn2)cc1
460787,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460788,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460789,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,45.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460790,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460791,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460792,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,45.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460793,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460794,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,346.09212,[M-H]-,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460795,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,382.0688,[M+Cl]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460796,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,382.0688,[M+Cl]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460797,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,382.0688,[M+Cl]-,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460798,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,382.0688,[M+Cl]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460799,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,392.0976,[M+FA]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460800,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,392.0976,[M+FA]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460801,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,392.0976,[M+FA]-,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460802,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,392.0976,[M+FA]-,15.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460803,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,392.0976,[M+FA]-,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460804,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460805,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460806,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,45.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460807,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460808,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460809,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,60.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460810,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,45.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460811,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1,348.10667,[M+H]+,20.0,val,Cc1nc(C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc(C(F)(F)F)n1
460812,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460813,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460814,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,60.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460815,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,30.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460816,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460817,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460818,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460819,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,60.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460820,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,30.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460821,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460822,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460823,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460824,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,60.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460825,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,30.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460826,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,312.07899,[M-H]-,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460827,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460828,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460829,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,60.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460830,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,30.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460831,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460832,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,60.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460833,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,30.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460834,COC(=O)Nc1nc2c(cc(C(=O)c3ccc(F)cc3)cc2)[nH]1,314.09355,[M+H]+,20.0,val,COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
460835,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460836,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460837,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,60.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460838,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,30.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460839,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460840,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,60.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460841,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,30.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460842,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460843,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460844,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460845,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,60.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460846,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,30.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460847,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460848,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,60.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460849,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,30.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460850,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1,279.07752,[M-H]-,20.0,val,Cc1ccc(-c2noc(-c3ccc(C(=O)O)cc3)n2)cc1
460851,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,20.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460852,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,20.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460853,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,60.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460854,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,30.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460855,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,20.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460856,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,60.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460857,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,30.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460858,N#C/C(=C\c1cc(O)c(O)cc1)C(=O)Nc1ccccc1,279.07752,[M-H]-,20.0,val,N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1
460859,NC(=O)c1c(Oc2ccccc2)oc(-c2ccccc2)n1,281.09207,[M+H]+,20.0,val,NC(=O)c1nc(-c2ccccc2)oc1Oc1ccccc1
460860,NC(=O)c1c(Oc2ccccc2)oc(-c2ccccc2)n1,281.09207,[M+H]+,20.0,val,NC(=O)c1nc(-c2ccccc2)oc1Oc1ccccc1
460861,NC(=O)c1c(Oc2ccccc2)oc(-c2ccccc2)n1,281.09207,[M+H]+,60.0,val,NC(=O)c1nc(-c2ccccc2)oc1Oc1ccccc1
460862,NC(=O)c1c(Oc2ccccc2)oc(-c2ccccc2)n1,281.09207,[M+H]+,15.0,val,NC(=O)c1nc(-c2ccccc2)oc1Oc1ccccc1
460863,NC(=O)c1c(Oc2ccccc2)oc(-c2ccccc2)n1,281.09207,[M+H]+,20.0,val,NC(=O)c1nc(-c2ccccc2)oc1Oc1ccccc1
460864,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,20.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460865,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,20.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460866,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,45.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460867,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,60.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460868,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,20.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460869,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,45.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460870,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,60.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460871,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23,281.09207,[M+H]+,20.0,val,COc1c(OC)c2nccc3c4ccccc4n(c1=O)c23
460872,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460873,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460874,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460875,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460876,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460877,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460878,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460879,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460880,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460881,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460882,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460883,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460884,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460885,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460886,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460887,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,367.07964,[M-H]-,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460888,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460889,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460890,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460891,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460892,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460893,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460894,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460895,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460896,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460897,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460898,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,60.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460899,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,30.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460900,O=[N+]([O-])c1cc2c(cc1)nc(COCc1nc3c(cc([N+](=O)[O-])cc3)[nH]1)[nH]2,369.09419,[M+H]+,20.0,val,O=[N+]([O-])c1ccc2nc(COCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1
460901,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,20.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460902,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,20.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460903,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,60.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460904,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,20.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460905,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,45.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460906,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,60.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460907,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,20.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460908,COc1c2c(=O)cc(-c3ccccc3)oc2ccc1,253.08592,[M+H]+,45.0,val,COc1cccc2oc(-c3ccccc3)cc(=O)c12
460909,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460910,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460911,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,60.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460912,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,15.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460913,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460914,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,60.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460915,COc1cc2c(cc1)c(=O)c(-c1ccccc1)co2,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)c(-c3ccccc3)coc2c1
460916,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1,251.07137,[M-H]-,20.0,val,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
460917,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1,251.07137,[M-H]-,20.0,val,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
460918,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1,251.07137,[M-H]-,60.0,val,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
460919,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1,251.07137,[M-H]-,30.0,val,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
460920,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1,251.07137,[M-H]-,20.0,val,COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
460921,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,20.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460922,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,20.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460923,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,60.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460924,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,20.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460925,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,60.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460926,COc1cc2c(cc1)oc(-c1ccccc1)cc2=O,253.08592,[M+H]+,20.0,val,COc1ccc2oc(-c3ccccc3)cc(=O)c2c1
460927,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460928,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460929,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460930,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460931,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460932,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460933,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1,253.08592,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3ccccc3o2)cc1
460934,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460935,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460936,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,60.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460937,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460938,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,45.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460939,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,60.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460940,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460941,COc1ccccc1-c1cc(=O)c2ccccc2o1,253.08592,[M+H]+,45.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460942,COc1ccccc1-c1cc(=O)c2ccccc2o1,275.06786,[M+Na]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460943,COc1ccccc1-c1cc(=O)c2ccccc2o1,275.06786,[M+Na]+,15.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460944,COc1ccccc1-c1cc(=O)c2ccccc2o1,275.06786,[M+Na]+,20.0,val,COc1ccccc1-c1cc(=O)c2ccccc2o1
460945,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,20.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460946,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,20.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460947,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,45.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460948,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,60.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460949,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,20.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460950,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,20.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460951,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,45.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460952,COc1c(-c2ccccc2)oc2ccccc2c1=O,253.08592,[M+H]+,60.0,val,COc1c(-c2ccccc2)oc2ccccc2c1=O
460953,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460954,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460955,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,60.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460956,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460957,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,60.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460958,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1,253.08592,[M+H]+,20.0,val,COc1ccc2c(=O)cc(-c3ccccc3)oc2c1
460959,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460960,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460961,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460962,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,30.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460963,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460964,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460965,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,30.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460966,COc1c(O)cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
460967,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O,299.05611,[M-H]-,20.0,val,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O
460968,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O,299.05611,[M-H]-,60.0,val,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O
460969,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O,299.05611,[M-H]-,20.0,val,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O
460970,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O,299.05611,[M-H]-,45.0,val,O=C1C=CC2=C3c4cc(O)c(O)cc4CC3(O)COC2=C1O
460971,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
460972,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
460973,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
460974,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
460975,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
460976,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460977,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460978,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460979,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460980,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,45.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460981,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460982,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460983,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,299.05611,[M-H]-,45.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460984,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,335.03279,[M+Cl]-,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460985,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,335.03279,[M+Cl]-,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460986,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,335.03279,[M+Cl]-,15.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
460987,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,299.05611,[M-H]-,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
460988,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,299.05611,[M-H]-,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
460989,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,299.05611,[M-H]-,60.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
460990,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,299.05611,[M-H]-,30.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
460991,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,299.05611,[M-H]-,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
460992,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460993,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460994,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460995,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460996,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460997,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460998,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
460999,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461000,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461001,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461002,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461003,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461004,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,45.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461005,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461006,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461007,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,45.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461008,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
461009,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
461010,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,301.07066,[M+H]+,20.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
461011,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
461012,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)cc3o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1
461013,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,301.07066,[M+H]+,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
461014,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,301.07066,[M+H]+,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
461015,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,301.07066,[M+H]+,60.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
461016,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,301.07066,[M+H]+,20.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
461017,COc1c(O)ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)c1,301.07066,[M+H]+,45.0,val,COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O
461018,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461019,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,45.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461020,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461021,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461022,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461023,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461024,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461025,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461026,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461027,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461028,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,299.05611,[M-H]-,20.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461029,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,299.05611,[M-H]-,20.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461030,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,299.05611,[M-H]-,60.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461031,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,299.05611,[M-H]-,20.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461032,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,299.05611,[M-H]-,45.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461033,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461034,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461035,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,299.05611,[M-H]-,60.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461036,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461037,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,299.05611,[M-H]-,45.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461038,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,299.05611,[M-H]-,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461039,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,299.05611,[M-H]-,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461040,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,299.05611,[M-H]-,60.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461041,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,299.05611,[M-H]-,30.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461042,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,299.05611,[M-H]-,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461043,COC(=O)c1c2c(=O)c3c(O)cc(C)cc3oc2cc(O)c1,299.05611,[M-H]-,20.0,val,COC(=O)c1cc(O)cc2oc3cc(C)cc(O)c3c(=O)c12
461044,COC(=O)c1c2c(=O)c3c(O)cc(C)cc3oc2cc(O)c1,299.05611,[M-H]-,20.0,val,COC(=O)c1cc(O)cc2oc3cc(C)cc(O)c3c(=O)c12
461045,COC(=O)c1c2c(=O)c3c(O)cc(C)cc3oc2cc(O)c1,299.05611,[M-H]-,60.0,val,COC(=O)c1cc(O)cc2oc3cc(C)cc(O)c3c(=O)c12
461046,COC(=O)c1c2c(=O)c3c(O)cc(C)cc3oc2cc(O)c1,299.05611,[M-H]-,20.0,val,COC(=O)c1cc(O)cc2oc3cc(C)cc(O)c3c(=O)c12
461047,COC(=O)c1c2c(=O)c3c(O)cc(C)cc3oc2cc(O)c1,299.05611,[M-H]-,60.0,val,COC(=O)c1cc(O)cc2oc3cc(C)cc(O)c3c(=O)c12
461048,COc1cc2c(C(=O)c3c(cc(CO)cc3O)C2=O)c(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(=O)c1cc(CO)cc(O)c1C2=O
461049,COc1cc2c(C(=O)c3c(cc(CO)cc3O)C2=O)c(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(=O)c1cc(CO)cc(O)c1C2=O
461050,COc1cc2c(C(=O)c3c(cc(CO)cc3O)C2=O)c(O)c1,299.05611,[M-H]-,60.0,val,COc1cc(O)c2c(c1)C(=O)c1cc(CO)cc(O)c1C2=O
461051,COc1cc2c(C(=O)c3c(cc(CO)cc3O)C2=O)c(O)c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(c1)C(=O)c1cc(CO)cc(O)c1C2=O
461052,COc1cc2c(C(=O)c3c(cc(CO)cc3O)C2=O)c(O)c1,299.05611,[M-H]-,45.0,val,COc1cc(O)c2c(c1)C(=O)c1cc(CO)cc(O)c1C2=O
461053,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461054,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461055,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461056,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,30.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461057,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461058,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461059,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,30.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461060,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,299.05611,[M-H]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461061,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461062,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461063,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,60.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461064,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,30.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461065,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,299.05611,[M-H]-,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461066,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,301.07066,[M+H]+,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461067,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,301.07066,[M+H]+,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461068,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,301.07066,[M+H]+,60.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461069,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,301.07066,[M+H]+,20.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461070,COc1c2c(=O)c(-c3c(O)cc(O)cc3)coc2cc(O)c1,301.07066,[M+H]+,45.0,val,COc1cc(O)cc2occ(-c3ccc(O)cc3O)c(=O)c12
461071,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,301.07066,[M+H]+,45.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461072,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,301.07066,[M+H]+,45.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461073,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,301.07066,[M+H]+,20.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461074,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,301.07066,[M+H]+,60.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461075,COc1cc(CO)cc2c1C(=O)c1c(cc(O)cc1O)C2=O,301.07066,[M+H]+,45.0,val,COc1cc(CO)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
461076,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,283.0601,[M+H-H2O]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461077,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,283.0601,[M+H-H2O]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461078,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,283.0601,[M+H-H2O]+,30.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461079,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,283.0601,[M+H-H2O]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461080,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,301.07066,[M+H]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461081,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,301.07066,[M+H]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461082,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,301.07066,[M+H]+,60.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461083,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,301.07066,[M+H]+,20.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461084,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O,301.07066,[M+H]+,45.0,val,COc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O
461085,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461086,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461087,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,60.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461088,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,15.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461089,COc1c(O)c2c(cc1O)oc(-c1ccc(O)cc1)cc2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O
461090,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461091,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461092,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461093,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461094,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461095,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461096,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461097,COc1ccc(-c2cc(=O)c3c(cc(O)c(O)c3O)o2)cc1,301.07066,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(O)c(O)c(O)cc3o2)cc1
461098,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461099,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461100,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,60.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461101,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,20.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461102,COc1c(O)c2c(cc1O)occ(-c1ccc(O)cc1)c2=O,301.07066,[M+H]+,45.0,val,COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O
461103,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461104,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461105,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,45.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461106,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,60.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461107,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461108,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,60.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461109,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,45.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461110,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,299.05611,[M-H]-,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461111,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461112,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461113,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,45.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461114,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,60.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461115,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461116,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,45.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461117,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,60.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461118,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,299.05611,[M-H]-,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461119,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461120,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461121,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,45.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461122,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,60.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461123,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461124,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,45.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461125,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,60.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461126,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O,301.07066,[M+H]+,20.0,val,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1O
461127,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,301.07066,[M+H]+,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461128,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,301.07066,[M+H]+,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461129,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,301.07066,[M+H]+,60.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461130,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,301.07066,[M+H]+,20.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461131,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1,301.07066,[M+H]+,60.0,val,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1
461132,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461133,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461134,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461135,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461136,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,45.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461137,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461138,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461139,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,380.00328,[M-H]-,45.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461140,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,364.00727,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461141,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,364.00727,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461142,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,364.00727,[M+H-H2O]+,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461143,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,364.00727,[M+H-H2O]+,30.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461144,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,364.00727,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461145,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,382.01783,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461146,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,382.01783,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461147,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,382.01783,[M+H]+,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461148,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,382.01783,[M+H]+,15.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461149,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2ccc(Cl)s2)[nH]nc1,382.01783,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1ccc(Cl)s1
461150,Cc1c2nc(Cl)c(/C=N/NC(=O)c3c(Cl)cnn3C)cc2ccc1,360.04244,[M-H]-,20.0,val,Cc1cccc2cc(/C=N/NC(=O)c3c(Cl)cnn3C)c(Cl)nc12
461151,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,352.01489,[M-H]-,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461152,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,352.01489,[M-H]-,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461153,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,352.01489,[M-H]-,60.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461154,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,352.01489,[M-H]-,15.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461155,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,352.01489,[M-H]-,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461156,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461157,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461158,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,60.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461159,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,15.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461160,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461161,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461162,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461163,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,60.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461164,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,15.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461165,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,354.02944,[M+H]+,20.0,val,O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
461166,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,315.05419,[M-H]-,45.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461167,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,315.05419,[M-H]-,45.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461168,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,315.05419,[M-H]-,45.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461169,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,315.05419,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461170,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,315.05419,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461171,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461172,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461173,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,60.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461174,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,15.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461175,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461176,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,15.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461177,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461178,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1,317.06875,[M+H]+,60.0,val,O=C(Cc1ccccc1Cl)NCc1cc(-c2ccco2)on1
461179,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461180,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461181,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,45.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461182,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461183,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461184,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,45.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461185,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461186,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1,317.06875,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)C(=O)NCCO2)c1cccc(Cl)c1
461187,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1,317.06875,[M+H]+,20.0,val,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1
461188,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1,317.06875,[M+H]+,20.0,val,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1
461189,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1,317.06875,[M+H]+,45.0,val,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1
461190,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1,317.06875,[M+H]+,60.0,val,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1
461191,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1,317.06875,[M+H]+,20.0,val,COc1cc(C)c2c(N)c(C(=O)c3ccc(Cl)cc3)oc2n1
461192,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,20.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461193,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,20.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461194,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,45.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461195,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,60.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461196,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,20.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461197,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,45.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461198,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,60.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461199,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12,317.06875,[M+H]+,20.0,val,COC(=O)COc1cccn2cc(-c3ccc(Cl)cc3)nc12
461200,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461201,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461202,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,60.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461203,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,15.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461204,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461205,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461206,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461207,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,60.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461208,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,30.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461209,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461210,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461211,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461212,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,60.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461213,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,15.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461214,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,327.04767,[M-H]-,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461215,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461216,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461217,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,60.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461218,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,30.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461219,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1,329.06222,[M+H]+,20.0,val,Clc1ccccc1C1Nn2c(Cc3ccccc3)nnc2S1
461220,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,351.0277,[M-H]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461221,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,351.0277,[M-H]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461222,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,351.0277,[M-H]-,60.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461223,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,351.0277,[M-H]-,30.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461224,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,351.0277,[M-H]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461225,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,387.00438,[M+Cl]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461226,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,387.00438,[M+Cl]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461227,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,387.00438,[M+Cl]-,60.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461228,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,387.00438,[M+Cl]-,15.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461229,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,387.00438,[M+Cl]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461230,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,397.03318,[M+FA]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461231,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,397.03318,[M+FA]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461232,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,397.03318,[M+FA]-,60.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461233,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,397.03318,[M+FA]-,15.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461234,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,397.03318,[M+FA]-,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461235,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,353.04226,[M+H]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461236,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,353.04226,[M+H]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461237,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,353.04226,[M+H]+,60.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461238,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,353.04226,[M+H]+,30.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461239,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,353.04226,[M+H]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461240,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,370.0688,[M+NH4]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461241,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,370.0688,[M+NH4]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461242,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,370.0688,[M+NH4]+,60.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461243,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,370.0688,[M+NH4]+,15.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461244,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c2cc(OC)cc3O)C1=O,370.0688,[M+NH4]+,20.0,val,COC1=C(Cl)[C@](C)(O)c2c(oc(=O)c3c(O)cc(OC)cc23)C1=O
461245,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461246,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461247,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,60.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461248,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,30.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461249,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461250,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,60.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461251,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,30.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461252,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461253,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,300.09539,[M-H]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461254,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,300.09539,[M-H]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461255,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,300.09539,[M-H]-,60.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461256,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,300.09539,[M-H]-,15.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461257,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,300.09539,[M-H]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461258,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,336.07207,[M+Cl]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461259,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,336.07207,[M+Cl]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461260,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,336.07207,[M+Cl]-,15.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461261,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,336.07207,[M+Cl]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461262,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,346.10087,[M+FA]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461263,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,346.10087,[M+FA]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461264,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,346.10087,[M+FA]-,60.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461265,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,346.10087,[M+FA]-,15.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461266,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,346.10087,[M+FA]-,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461267,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461268,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461269,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,60.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461270,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,30.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461271,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461272,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,30.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461273,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,60.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461274,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12,302.10994,[M+H]+,20.0,val,Cc1cccn2cc(C(=O)NCc3cc(F)cc(F)c3)nc12
461275,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,302.10994,[M+H]+,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461276,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,302.10994,[M+H]+,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461277,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,302.10994,[M+H]+,60.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461278,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,302.10994,[M+H]+,30.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461279,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21,302.10994,[M+H]+,20.0,val,Cn1cc(NC(=O)Nc2ccc(F)c(F)c2)c2ccccc21
461280,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,283.08883,[M-H]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461281,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,283.08883,[M-H]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461282,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,283.08883,[M-H]-,60.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461283,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,283.08883,[M-H]-,30.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461284,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,283.08883,[M-H]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461285,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,319.06551,[M+Cl]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461286,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,319.06551,[M+Cl]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461287,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,319.06551,[M+Cl]-,60.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461288,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,319.06551,[M+Cl]-,15.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461289,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,319.06551,[M+Cl]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461290,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,329.09431,[M+FA]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461291,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,329.09431,[M+FA]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461292,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,329.09431,[M+FA]-,60.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461293,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,329.09431,[M+FA]-,15.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461294,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,329.09431,[M+FA]-,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461295,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,285.10338,[M+H]+,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461296,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,285.10338,[M+H]+,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461297,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,285.10338,[M+H]+,60.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461298,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,285.10338,[M+H]+,30.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461299,O=C(NCc1cc(O)ccc1)c1cc2c(ccc(F)c2)[nH]1,285.10338,[M+H]+,20.0,val,O=C(NCc1cccc(O)c1)c1cc2cc(F)ccc2[nH]1
461300,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461301,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461302,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461303,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,30.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461304,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461305,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,30.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461306,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461307,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,331.03806,[M-H]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461308,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,367.01473,[M+Cl]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461309,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,367.01473,[M+Cl]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461310,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,367.01473,[M+Cl]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461311,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,367.01473,[M+Cl]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461312,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461313,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461314,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461315,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,15.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461316,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461317,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,15.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461318,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461319,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,377.04354,[M+FA]-,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461320,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,20.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461321,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,20.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461322,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,45.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461323,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,60.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461324,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,20.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461325,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,45.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461326,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,60.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461327,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C,333.05261,[M+H]+,20.0,val,Cc1sc2ncnc(SCC(=O)c3ccccc3F)c2c1C
461328,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1,333.05261,[M+H]+,20.0,val,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1
461329,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1,333.05261,[M+H]+,20.0,val,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1
461330,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1,333.05261,[M+H]+,45.0,val,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1
461331,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1,333.05261,[M+H]+,60.0,val,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1
461332,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1,333.05261,[M+H]+,20.0,val,CCc1cc2c(SCC(=O)c3ccc(F)cc3)ncnc2s1
461333,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461334,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461335,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,45.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461336,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461337,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461338,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461339,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,45.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461340,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1,333.05261,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)CSc3ccc(F)cc3)ccc2s1
461341,Cn1nc2ccccc2c1-c1noc(-c2cc(=O)n(C)cc2)n1,308.1142,[M+H]+,20.0,val,Cn1nc2ccccc2c1-c1noc(-c2ccn(C)c(=O)c2)n1
461342,Cn1nc2ccccc2c1-c1noc(-c2cc(=O)n(C)cc2)n1,308.1142,[M+H]+,20.0,val,Cn1nc2ccccc2c1-c1noc(-c2ccn(C)c(=O)c2)n1
461343,Cn1nc2ccccc2c1-c1noc(-c2cc(=O)n(C)cc2)n1,308.1142,[M+H]+,60.0,val,Cn1nc2ccccc2c1-c1noc(-c2ccn(C)c(=O)c2)n1
461344,Cn1nc2ccccc2c1-c1noc(-c2cc(=O)n(C)cc2)n1,308.1142,[M+H]+,20.0,val,Cn1nc2ccccc2c1-c1noc(-c2ccn(C)c(=O)c2)n1
461345,Cn1nc2ccccc2c1-c1noc(-c2cc(=O)n(C)cc2)n1,308.1142,[M+H]+,45.0,val,Cn1nc2ccccc2c1-c1noc(-c2ccn(C)c(=O)c2)n1
461346,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461347,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461348,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,60.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461349,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,30.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461350,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461351,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,60.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461352,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,30.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461353,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461354,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461355,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461356,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,60.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461357,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,30.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461358,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461359,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461360,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,30.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461361,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,306.09965,[M-H]-,60.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461362,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,342.07633,[M+Cl]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461363,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,342.07633,[M+Cl]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461364,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,342.07633,[M+Cl]-,60.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461365,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1,342.07633,[M+Cl]-,20.0,val,Cc1nc(Cn2cccc2C(=O)Nc2cccc(C#N)c2)no1
461366,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,370.04379,[M-H]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461367,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,370.04379,[M-H]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461368,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,370.04379,[M-H]-,60.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461369,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,370.04379,[M-H]-,30.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461370,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,370.04379,[M-H]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461371,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,416.04927,[M+FA]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461372,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,416.04927,[M+FA]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461373,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,416.04927,[M+FA]-,60.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461374,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,416.04927,[M+FA]-,15.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461375,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,416.04927,[M+FA]-,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461376,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,372.05834,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461377,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,372.05834,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461378,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,372.05834,[M+H]+,60.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461379,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,372.05834,[M+H]+,15.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461380,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1,372.05834,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1ccc(-c2nc(-c3cccs3)no2)s1
461381,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,20.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461382,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,20.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461383,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,60.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461384,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,20.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461385,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,60.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461386,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1,314.04925,[M-H]-,20.0,val,COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1
461387,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461388,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461389,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461390,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,30.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461391,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461392,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461393,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461394,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,374.01458,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461395,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,409.99125,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461396,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,409.99125,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461397,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461398,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461399,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,60.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461400,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461401,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,60.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461402,COc1c(OC)cc2c(Nc3cc(Br)c(O)cc3)ncnc2c1,376.02913,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC
461403,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,414.99277,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461404,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,414.99277,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461405,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,414.99277,[M-H]-,60.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461406,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,414.99277,[M-H]-,15.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461407,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,414.99277,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461408,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,450.96945,[M+Cl]-,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461409,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,450.96945,[M+Cl]-,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461410,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,417.00732,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461411,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,417.00732,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461412,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,417.00732,[M+H]+,60.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461413,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,417.00732,[M+H]+,15.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461414,NS(=O)(=O)c1c(Cl)cc(Cl)c(C(=O)OCCNC(=O)c2ccccc2)c1,417.00732,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)OCCNC(=O)c2ccccc2)c(Cl)cc1Cl
461415,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,380.07313,[M-H]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461416,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,380.07313,[M-H]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461417,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,380.07313,[M-H]-,60.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461418,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,380.07313,[M-H]-,15.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461419,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,380.07313,[M-H]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461420,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,416.04981,[M+Cl]-,15.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461421,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,416.04981,[M+Cl]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461422,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,416.04981,[M+Cl]-,60.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461423,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,416.04981,[M+Cl]-,15.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461424,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461425,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461426,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,60.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461427,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,15.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461428,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461429,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,60.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461430,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,15.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461431,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,426.07861,[M+FA]-,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461432,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,382.08768,[M+H]+,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461433,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,382.08768,[M+H]+,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461434,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,382.08768,[M+H]+,60.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461435,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,382.08768,[M+H]+,30.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461436,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1,382.08768,[M+H]+,20.0,val,Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)F)n1
461437,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461438,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461439,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461440,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461441,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461442,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461443,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461444,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,347.07166,[M-H]-,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461445,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461446,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461447,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,349.08621,[M+H]+,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461448,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461449,Cc1c(-n2c(=O)[nH]c(=O)c3cc(F)c(Cl)nc32)c(C(C)C)ncc1,349.08621,[M+H]+,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461450,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,347.07166,[M-H]-,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461451,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,347.07166,[M-H]-,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461452,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,347.07166,[M-H]-,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461453,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,347.07166,[M-H]-,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461454,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,347.07166,[M-H]-,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461455,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461456,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461457,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,45.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461458,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461459,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,20.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461460,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21,349.08621,[M+H]+,60.0,val,Cc1ccnc(C(C)C)c1-n1c(=O)[nH]c(=O)c2cc(F)c(Cl)nc21
461461,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,20.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461462,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,20.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461463,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,60.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461464,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,30.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461465,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,20.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461466,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,60.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461467,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,30.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461468,Cc1cc(C2CCCN2c2nc3cc(F)c(F)cc3nc2)no1,317.12084,[M+H]+,20.0,val,Cc1cc(C2CCCN2c2cnc3cc(F)c(F)cc3n2)no1
461469,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461470,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461471,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,45.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461472,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,60.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461473,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461474,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,45.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461475,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,60.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461476,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,416.03559,[M-H]-,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461477,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,452.01227,[M+Cl]-,15.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461478,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,452.01227,[M+Cl]-,15.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461479,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,452.01227,[M+Cl]-,60.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461480,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,452.01227,[M+Cl]-,15.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461481,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,418.05014,[M+H]+,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461482,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,418.05014,[M+H]+,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461483,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,418.05014,[M+H]+,45.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461484,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,418.05014,[M+H]+,60.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461485,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1,418.05014,[M+H]+,20.0,val,Cn1nc(-c2cccs2)cc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1
461486,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461487,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461488,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,45.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461489,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,60.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461490,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461491,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461492,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461493,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,60.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461494,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,15.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461495,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2,310.10494,[M+H]+,20.0,val,FC(F)(F)c1ccccc1CNCc1ccc2c(c1)OCO2
461496,COC(=O)CN1C(=O)N(c2cc(F)c(C)cc2)c2c(cccn2)S1(=O)=O,380.0711,[M+H]+,20.0,val,COC(=O)CN1C(=O)N(c2ccc(C)c(F)c2)c2ncccc2S1(=O)=O
461497,COC(=O)CN1C(=O)N(c2cc(F)c(C)cc2)c2c(cccn2)S1(=O)=O,380.0711,[M+H]+,20.0,val,COC(=O)CN1C(=O)N(c2ccc(C)c(F)c2)c2ncccc2S1(=O)=O
461498,COC(=O)CN1C(=O)N(c2cc(F)c(C)cc2)c2c(cccn2)S1(=O)=O,380.0711,[M+H]+,60.0,val,COC(=O)CN1C(=O)N(c2ccc(C)c(F)c2)c2ncccc2S1(=O)=O
461499,COC(=O)CN1C(=O)N(c2cc(F)c(C)cc2)c2c(cccn2)S1(=O)=O,380.0711,[M+H]+,30.0,val,COC(=O)CN1C(=O)N(c2ccc(C)c(F)c2)c2ncccc2S1(=O)=O
461500,COC(=O)CN1C(=O)N(c2cc(F)c(C)cc2)c2c(cccn2)S1(=O)=O,380.0711,[M+H]+,20.0,val,COC(=O)CN1C(=O)N(c2ccc(C)c(F)c2)c2ncccc2S1(=O)=O
461501,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461502,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461503,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,60.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461504,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,30.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461505,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461506,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,60.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461507,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,30.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461508,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(-c2nc(Cc3ccccc3)no2)cc1
461509,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,20.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461510,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,20.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461511,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,60.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461512,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,15.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461513,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,20.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461514,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,45.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461515,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,60.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461516,Cc1c2oc(C(=O)NCc3cnccc3)cc2ccc1,267.1128,[M+H]+,20.0,val,Cc1cccc2cc(C(=O)NCc3cccnc3)oc12
461517,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1,267.1128,[M+H]+,20.0,val,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1
461518,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1,267.1128,[M+H]+,20.0,val,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1
461519,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1,267.1128,[M+H]+,60.0,val,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1
461520,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1,267.1128,[M+H]+,15.0,val,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1
461521,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1,267.1128,[M+H]+,20.0,val,O=C(CN1Cc2ccccc2C1=O)Nc1ccccc1
461522,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461523,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461524,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,60.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461525,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461526,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,60.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461527,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,265.09825,[M-H]-,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461528,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,20.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461529,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,20.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461530,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,60.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461531,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,20.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461532,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,45.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461533,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,60.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461534,COc1c(OC)cc2nc(-c3ccccc3)cnc2c1,267.1128,[M+H]+,20.0,val,COc1cc2ncc(-c3ccccc3)nc2cc1OC
461535,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461536,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461537,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,60.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461538,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461539,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,45.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461540,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,60.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461541,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,20.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461542,COc1c(OC)cc(/C=C(/C#N)c2cnccc2)cc1,267.1128,[M+H]+,45.0,val,COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC
461543,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,267.1128,[M+H]+,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461544,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,267.1128,[M+H]+,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461545,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,267.1128,[M+H]+,60.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461546,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,267.1128,[M+H]+,20.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461547,Cc1cc2ncc(-c3cc(O)c(O)cc3)nc2cc1C,267.1128,[M+H]+,60.0,val,Cc1cc2ncc(-c3ccc(O)c(O)c3)nc2cc1C
461548,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,345.03731,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461549,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,345.03731,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461550,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,345.03731,[M-H]-,60.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461551,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,345.03731,[M-H]-,15.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461552,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,345.03731,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461553,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,30.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461554,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,30.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461555,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461556,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461557,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,30.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461558,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,30.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461559,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461560,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1,347.05186,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2s1
461561,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461562,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461563,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,60.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461564,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,30.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461565,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461566,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,60.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461567,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,30.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461568,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,277.10949,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461569,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,313.08616,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461570,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,313.08616,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461571,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,313.08616,[M+Cl]-,60.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461572,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,313.08616,[M+Cl]-,15.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461573,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,313.08616,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461574,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,20.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461575,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,20.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461576,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,60.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461577,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,30.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461578,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,20.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461579,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,60.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461580,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,30.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461581,c1nccc(-c2nc(C3(c4ccncc4)CCC3)no2)c1,279.12404,[M+H]+,20.0,val,c1cc(-c2nc(C3(c4ccncc4)CCC3)no2)ccn1
461582,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461583,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461584,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,60.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461585,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,30.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461586,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461587,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,60.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461588,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,30.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461589,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1,279.12404,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1cc(-c2ccncc2)n[nH]1
461590,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,20.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461591,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,20.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461592,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,60.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461593,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,20.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461594,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,45.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461595,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,60.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461596,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,20.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461597,Cc1c2cc(NCc3cc4c(cc3)occ4)cnc2n[nH]1,279.12404,[M+H]+,45.0,val,Cc1[nH]nc2ncc(NCc3ccc4occc4c3)cc12
461598,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461599,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461600,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,60.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461601,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461602,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,45.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461603,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,60.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461604,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461605,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,277.10949,[M-H]-,45.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461606,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,20.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461607,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,20.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461608,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,60.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461609,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,30.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461610,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,20.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461611,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,60.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461612,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,30.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461613,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1,279.12404,[M+H]+,20.0,val,CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccccc1
461614,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,279.12404,[M+H]+,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461615,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,279.12404,[M+H]+,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461616,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,279.12404,[M+H]+,60.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461617,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,279.12404,[M+H]+,20.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461618,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O,279.12404,[M+H]+,45.0,val,CC(C)c1c(-c2ccccc2)nc2c(C#N)c[nH]n2c1=O
461619,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,20.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461620,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,20.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461621,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,60.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461622,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,30.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461623,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,20.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461624,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,45.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461625,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,60.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461626,c1ccc(-c2nc(CCNc3c4cn[nH]c4ncn3)co2)cc1,307.13018,[M+H]+,20.0,val,c1ccc(-c2nc(CCNc3ncnc4[nH]ncc34)co2)cc1
461627,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,305.11563,[M-H]-,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461628,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,305.11563,[M-H]-,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461629,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,305.11563,[M-H]-,60.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461630,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,305.11563,[M-H]-,30.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461631,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,305.11563,[M-H]-,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461632,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N,307.13018,[M+H]+,20.0,val,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N
461633,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N,307.13018,[M+H]+,20.0,val,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N
461634,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N,307.13018,[M+H]+,45.0,val,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N
461635,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N,307.13018,[M+H]+,60.0,val,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N
461636,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N,307.13018,[M+H]+,20.0,val,CCc1nn(-c2cc(Oc3ccccc3)ncn2)c(N)c1C#N
461637,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,307.13018,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461638,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,307.13018,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461639,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,307.13018,[M+H]+,45.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461640,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,307.13018,[M+H]+,60.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461641,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,307.13018,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461642,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461643,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461644,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,45.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461645,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,60.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461646,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461647,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,60.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461648,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1,329.11213,[M+Na]+,20.0,val,O=C(c1cnccn1)N1CCn2c(nnc2-c2ccccc2)C1
461649,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461650,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461651,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,60.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461652,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,30.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461653,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461654,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,60.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461655,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,30.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461656,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1,307.13018,[M+H]+,20.0,val,Nc1c(C(=O)N/N=C/c2cccnc2)cnn1-c1ccccc1
461657,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461658,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461659,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461660,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461661,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461662,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461663,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461664,COc1ccc(/C=C/C(=O)c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2ccccc2)cc1
461665,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461666,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461667,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,60.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461668,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,30.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461669,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461670,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,30.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461671,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,60.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461672,COc1ccc(C(=O)/C=C/c2ccccc2)cc1,239.10666,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccccc2)cc1
461673,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,401.03671,[M-H]-,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461674,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,401.03671,[M-H]-,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461675,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,401.03671,[M-H]-,60.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461676,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,401.03671,[M-H]-,30.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461677,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,401.03671,[M-H]-,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461678,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,403.05126,[M+H]+,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461679,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,403.05126,[M+H]+,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461680,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,403.05126,[M+H]+,60.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461681,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,403.05126,[M+H]+,20.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461682,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1,403.05126,[M+H]+,45.0,val,CNC(=O)Cn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1
461683,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461684,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461685,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461686,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461687,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461688,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461689,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461690,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,350.04686,[M-H]-,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461691,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461692,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461693,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461694,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461695,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461696,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461697,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461698,O=C(Cn1cnc2c(CCCC2)c1=O)Nc1cc(Cl)c(Cl)cc1,352.06141,[M+H]+,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)Nc1ccc(Cl)c(Cl)c1
461699,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461700,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461701,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461702,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,30.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461703,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461704,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461705,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461706,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,333.047,[M-H]-,30.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461707,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,369.02368,[M+Cl]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461708,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,369.02368,[M+Cl]-,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461709,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,369.02368,[M+Cl]-,15.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461710,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,369.02368,[M+Cl]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461711,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,379.05248,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461712,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,379.05248,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461713,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,379.05248,[M+FA]-,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461714,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,379.05248,[M+FA]-,15.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461715,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,379.05248,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461716,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl,335.06155,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl
461717,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl,335.06155,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl
461718,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl,335.06155,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl
461719,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl,335.06155,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl
461720,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl,335.06155,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)n2c(C)nc3ccccc32)c(C)cc1Cl
461721,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461722,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461723,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461724,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,30.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461725,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461726,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,60.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461727,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,30.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461728,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1,335.06155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccs1
461729,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,20.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461730,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,20.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461731,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,60.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461732,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,30.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461733,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,20.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461734,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,60.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461735,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,30.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461736,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12,335.06155,[M+H]+,20.0,val,CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c2ccccc12
461737,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,318.10596,[M-H]-,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461738,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,318.10596,[M-H]-,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461739,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,318.10596,[M-H]-,60.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461740,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,318.10596,[M-H]-,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461741,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,318.10596,[M-H]-,45.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461742,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461743,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461744,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,60.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461745,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,15.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461746,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461747,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,45.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461748,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,60.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461749,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461750,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461751,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461752,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,60.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461753,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461754,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,45.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461755,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,60.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461756,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,20.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461757,O=C(c1cnc(OC(F)F)cc1)N1CCCC1c1ccncc1,320.12051,[M+H]+,45.0,val,O=C(c1ccc(OC(F)F)nc1)N1CCCC1c1ccncc1
461758,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461759,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461760,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,60.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461761,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461762,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,45.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461763,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,60.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461764,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,20.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461765,O=C(c1cc2c(cncc2)c(=O)[nH]1)N1CCC2(CC1)CC2(F)F,320.12051,[M+H]+,45.0,val,O=C(c1cc2ccncc2c(=O)[nH]1)N1CCC2(CC1)CC2(F)F
461766,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461767,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461768,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,60.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461769,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,15.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461770,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461771,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,15.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461772,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461773,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,318.10596,[M-H]-,60.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461774,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,364.11144,[M+FA]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461775,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,364.11144,[M+FA]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461776,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,364.11144,[M+FA]-,60.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461777,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,364.11144,[M+FA]-,15.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461778,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,364.11144,[M+FA]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461779,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,20.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461780,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,20.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461781,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,45.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461782,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,60.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461783,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,20.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461784,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,45.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461785,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,60.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461786,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2,320.12051,[M+H]+,20.0,val,O=C(Nc1cccc(OC(F)F)c1)c1ncnc2c1CCCC2
461787,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461788,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461789,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,60.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461790,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,30.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461791,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461792,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461793,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,60.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461794,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1,320.12051,[M+H]+,30.0,val,CNC(=O)Cc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
461795,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,20.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461796,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,20.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461797,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,60.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461798,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,15.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461799,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,20.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461800,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,60.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461801,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,20.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461802,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1,320.12051,[M+H]+,15.0,val,O=C(c1ccccc1F)N1CCC(Oc2ncc(F)cn2)CC1
461803,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,308.1153,[M-H]-,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461804,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,308.1153,[M-H]-,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461805,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,308.1153,[M-H]-,60.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461806,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,308.1153,[M-H]-,15.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461807,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,308.1153,[M-H]-,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461808,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,310.12985,[M+H]+,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461809,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,310.12985,[M+H]+,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461810,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,310.12985,[M+H]+,60.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461811,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,310.12985,[M+H]+,30.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461812,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1,310.12985,[M+H]+,20.0,val,Cn1nncc1C(=O)Nc1ccc(OCc2ccncc2)cc1
461813,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,20.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461814,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,20.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461815,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,60.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461816,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,30.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461817,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,20.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461818,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,60.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461819,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,30.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461820,Cc1c(C(=O)Nc2nncn2C2CC2)c(-c2ccccc2)no1,310.12985,[M+H]+,20.0,val,Cc1onc(-c2ccccc2)c1C(=O)Nc1nncn1C1CC1
461821,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,20.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461822,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,20.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461823,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,60.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461824,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,20.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461825,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,45.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461826,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,60.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461827,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,20.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461828,O=C(Nc1c(-c2ccccn2)[nH]nc1)c1noc2c1CCCC2,310.12985,[M+H]+,45.0,val,O=C(Nc1cn[nH]c1-c1ccccn1)c1noc2c1CCCC2
461829,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461830,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461831,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461832,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461833,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461834,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461835,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461836,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461837,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461838,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461839,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,310.12985,[M+H]+,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461840,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,310.12985,[M+H]+,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461841,CCc1cc(NC(=O)Cc2nnc(-c3nccnc3)o2)ccc1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461842,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461843,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461844,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461845,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461846,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461847,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461848,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461849,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,308.1153,[M-H]-,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461850,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,344.09198,[M+Cl]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461851,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,344.09198,[M+Cl]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461852,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,344.09198,[M+Cl]-,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461853,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,344.09198,[M+Cl]-,15.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461854,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,344.09198,[M+Cl]-,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461855,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,308.1153,[M-H]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461856,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,308.1153,[M-H]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461857,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,308.1153,[M-H]-,60.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461858,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,308.1153,[M-H]-,30.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461859,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,308.1153,[M-H]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461860,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,354.12078,[M+FA]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461861,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,354.12078,[M+FA]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461862,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,354.12078,[M+FA]-,60.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461863,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,354.12078,[M+FA]-,15.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461864,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,354.12078,[M+FA]-,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461865,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461866,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461867,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,60.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461868,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,30.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461869,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461870,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461871,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,30.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461872,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,308.1153,[M-H]-,60.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461873,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,354.12078,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461874,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,354.12078,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461875,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,354.12078,[M+FA]-,60.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461876,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,354.12078,[M+FA]-,15.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461877,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,354.12078,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461878,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,308.1153,[M-H]-,20.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461879,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,308.1153,[M-H]-,20.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461880,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,308.1153,[M-H]-,60.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461881,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,308.1153,[M-H]-,60.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461882,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461883,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461884,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,60.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461885,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,30.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461886,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461887,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461888,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,30.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461889,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,308.1153,[M-H]-,60.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461890,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,344.09198,[M+Cl]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461891,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,344.09198,[M+Cl]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461892,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,344.09198,[M+Cl]-,60.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461893,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,344.09198,[M+Cl]-,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461894,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,20.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461895,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,20.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461896,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,45.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461897,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,60.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461898,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,20.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461899,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,60.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461900,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,45.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461901,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1,310.12985,[M+H]+,20.0,val,c1ccc(-c2nc(-c3ccnc(N4CCOCC4)c3)no2)nc1
461902,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1,310.12985,[M+H]+,20.0,val,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1
461903,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1,310.12985,[M+H]+,20.0,val,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1
461904,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1,310.12985,[M+H]+,60.0,val,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1
461905,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1,310.12985,[M+H]+,30.0,val,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1
461906,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1,310.12985,[M+H]+,20.0,val,O=C(NCCOc1ccccc1)c1ccc(-n2cccn2)nn1
461907,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,310.12985,[M+H]+,30.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461908,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,310.12985,[M+H]+,30.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461909,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,310.12985,[M+H]+,20.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461910,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,310.12985,[M+H]+,60.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461911,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1,310.12985,[M+H]+,30.0,val,COc1ccccc1/C=N/NC(=O)Cn1nc2ccccc2n1
461912,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461913,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461914,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,60.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461915,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,30.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461916,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461917,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,60.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461918,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,30.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461919,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1,310.12985,[M+H]+,20.0,val,O=C(NCCc1ccccc1)Nc1ccc2[nH]nnc(=O)c2c1
461920,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461921,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461922,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,60.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461923,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,30.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461924,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461925,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,60.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461926,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,30.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461927,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1,310.12985,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccc(C#N)cn3)CC2=O)ccn1
461928,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461929,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461930,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461931,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461932,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461933,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,60.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461934,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,30.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461935,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1,310.12985,[M+H]+,20.0,val,CCc1cccc(NC(=O)Cc2nnc(-c3cnccn3)o2)c1
461936,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N,310.12985,[M+H]+,30.0,val,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N
461937,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N,310.12985,[M+H]+,30.0,val,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N
461938,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N,310.12985,[M+H]+,20.0,val,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N
461939,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N,310.12985,[M+H]+,60.0,val,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N
461940,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N,310.12985,[M+H]+,30.0,val,CCOC(=O)c1cnn(-c2ccc(-c3ccccc3)nn2)c1N
461941,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1,310.12985,[M+H]+,20.0,val,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1
461942,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1,310.12985,[M+H]+,20.0,val,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1
461943,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1,310.12985,[M+H]+,60.0,val,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1
461944,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1,310.12985,[M+H]+,15.0,val,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1
461945,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1,310.12985,[M+H]+,20.0,val,O=C(NCc1cccnc1)NCc1nccnc1-c1ccco1
461946,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,310.12985,[M+H]+,20.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461947,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,310.12985,[M+H]+,20.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461948,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,310.12985,[M+H]+,60.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461949,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,310.12985,[M+H]+,20.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461950,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12,310.12985,[M+H]+,60.0,val,O=c1nc(-c2ccccc2)[nH]c2nc(N3CCOCC3)ncc12
461951,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461952,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461953,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,60.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461954,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461955,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,45.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461956,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,60.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461957,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461958,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,372.0772,[M-H]-,45.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461959,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,374.09175,[M+H]+,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461960,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,374.09175,[M+H]+,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461961,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,374.09175,[M+H]+,60.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461962,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,374.09175,[M+H]+,20.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461963,CCOc1c(S(=O)(=O)NC(=O)c2ccc(-n3cnnc3)cc2)cccn1,374.09175,[M+H]+,45.0,val,CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(-n2cnnc2)cc1
461964,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461965,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461966,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,60.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461967,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,30.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461968,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461969,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,60.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461970,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,30.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461971,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,324.09246,[M-H]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461972,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,360.06913,[M+Cl]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461973,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,360.06913,[M+Cl]-,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461974,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,360.06913,[M+Cl]-,60.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461975,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,360.06913,[M+Cl]-,15.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461976,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,20.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461977,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,20.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461978,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,60.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461979,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,30.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461980,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,20.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461981,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,60.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461982,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,30.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461983,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1,326.10701,[M+H]+,20.0,val,Cc1cnc(C(=O)NCCc2nc(-c3ccccn3)cs2)cn1
461984,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461985,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461986,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,60.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461987,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,30.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461988,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461989,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,60.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461990,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,30.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461991,O=C(CNc1c2ccsc2nc(-c2ccccn2)n1)NC1CC1,326.10701,[M+H]+,20.0,val,O=C(CNc1nc(-c2ccccn2)nc2sccc12)NC1CC1
461992,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461993,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461994,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,60.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461995,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,30.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461996,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461997,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,60.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461998,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,30.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
461999,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1,326.10701,[M+H]+,20.0,val,CN(C)c1ncc(NC(=O)c2nc(-c3ccccc3)cs2)cn1
462000,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462001,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462002,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,60.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462003,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,30.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462004,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462005,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462006,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,30.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462007,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,324.09246,[M-H]-,60.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462008,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,360.06913,[M+Cl]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462009,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,360.06913,[M+Cl]-,15.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462010,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,360.06913,[M+Cl]-,15.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462011,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,370.09793,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462012,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,370.09793,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462013,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,370.09793,[M+FA]-,60.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462014,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,370.09793,[M+FA]-,15.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462015,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,370.09793,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462016,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1,326.10701,[M+H]+,20.0,val,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1
462017,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1,326.10701,[M+H]+,20.0,val,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1
462018,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1,326.10701,[M+H]+,60.0,val,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1
462019,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1,326.10701,[M+H]+,30.0,val,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1
462020,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1,326.10701,[M+H]+,20.0,val,O=C(c1ccc2snnc2c1)N1CCN(c2ccccn2)CC1
462021,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12,326.10701,[M+H]+,20.0,val,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12
462022,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12,326.10701,[M+H]+,20.0,val,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12
462023,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12,326.10701,[M+H]+,45.0,val,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12
462024,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12,326.10701,[M+H]+,60.0,val,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12
462025,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12,326.10701,[M+H]+,20.0,val,Cc1occc1-c1nnc2sc(-c3cccc(N(C)C)c3)nn12
462026,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462027,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462028,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,30.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462029,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462030,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,15.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462031,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462032,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,60.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462033,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1,326.10701,[M+H]+,20.0,val,Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1
462034,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,20.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462035,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,20.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462036,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,60.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462037,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,30.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462038,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,20.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462039,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,20.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462040,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,60.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462041,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21,326.10701,[M+H]+,30.0,val,Cn1cnc2c(NCC(c3ccsc3)c3ccco3)ncnc21
462042,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462043,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462044,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,45.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462045,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,60.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462046,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462047,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,45.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462048,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,60.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462049,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1,326.10701,[M+H]+,20.0,val,O=C(Cc1cccnc1)NC1CN(c2ncnc3ccsc23)C1
462050,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,316.08266,[M-H]-,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462051,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,316.08266,[M-H]-,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462052,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,316.08266,[M-H]-,60.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462053,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,316.08266,[M-H]-,30.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462054,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,316.08266,[M-H]-,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462055,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462056,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462057,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,60.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462058,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462059,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,45.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462060,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,60.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462061,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,20.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462062,COc1c(O)ccc2c1n(C)c1c(c(O)cc(O)c1OC)c2=O,318.09721,[M+H]+,45.0,val,COc1c(O)ccc2c(=O)c3c(O)cc(O)c(OC)c3n(C)c12
462063,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O,316.08266,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O
462064,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O,316.08266,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O
462065,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O,316.08266,[M-H]-,60.0,val,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O
462066,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O,316.08266,[M-H]-,15.0,val,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O
462067,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O,316.08266,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)C1C2C=CC(O2)C1C(=O)O
462068,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2,382.0107,[M+H]+,15.0,val,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2
462069,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2,382.0107,[M+H]+,15.0,val,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2
462070,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2,382.0107,[M+H]+,20.0,val,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2
462071,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2,382.0107,[M+H]+,60.0,val,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2
462072,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2,382.0107,[M+H]+,15.0,val,CC(NC(=O)c1cccs1)c1cc2c(cc1Br)OCCCO2
462073,CC1CN(C(=O)c2cc3c(ccc(Br)c3)oc2=O)CC(C)O1,366.03355,[M+H]+,20.0,val,CC1CN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC(C)O1
462074,CC1CN(C(=O)c2cc3c(ccc(Br)c3)oc2=O)CC(C)O1,366.03355,[M+H]+,20.0,val,CC1CN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC(C)O1
462075,CC1CN(C(=O)c2cc3c(ccc(Br)c3)oc2=O)CC(C)O1,366.03355,[M+H]+,60.0,val,CC1CN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC(C)O1
462076,CC1CN(C(=O)c2cc3c(ccc(Br)c3)oc2=O)CC(C)O1,366.03355,[M+H]+,30.0,val,CC1CN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC(C)O1
462077,CC1CN(C(=O)c2cc3c(ccc(Br)c3)oc2=O)CC(C)O1,366.03355,[M+H]+,20.0,val,CC1CN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC(C)O1
462078,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462079,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462080,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,60.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462081,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,15.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462082,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462083,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,60.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462084,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,15.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462085,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,356.10321,[M-H]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462086,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,392.07989,[M+Cl]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462087,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,392.07989,[M+Cl]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462088,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,392.07989,[M+Cl]-,60.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462089,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,392.07989,[M+Cl]-,15.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462090,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,392.07989,[M+Cl]-,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462091,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,358.11776,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462092,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,358.11776,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462093,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,358.11776,[M+H]+,60.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462094,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,358.11776,[M+H]+,15.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462095,O=C(Nc1ccccc1Cl)N1CCN(c2cc3nncn3nc2)CC1,358.11776,[M+H]+,20.0,val,O=C(Nc1ccccc1Cl)N1CCN(c2cnn3cnnc3c2)CC1
462096,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,20.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462097,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,20.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462098,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,60.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462099,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,20.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462100,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,45.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462101,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,60.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462102,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,20.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462103,CC(C)n1cnc2c(NCc3cc(C(F)(F)F)ccc3)ncnc21,336.14306,[M+H]+,45.0,val,CC(C)n1cnc2c(NCc3cccc(C(F)(F)F)c3)ncnc21
462104,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462105,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462106,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,60.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462107,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,30.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462108,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462109,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,60.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462110,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,30.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462111,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,390.04509,[M-H]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462112,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462113,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462114,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,426.02177,[M+Cl]-,60.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462115,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,426.02177,[M+Cl]-,15.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462116,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NCC(O)(c1cccs1)C1CC1)c1cccc(C(F)(F)F)c1
462117,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,390.04509,[M-H]-,20.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462118,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,390.04509,[M-H]-,20.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462119,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,390.04509,[M-H]-,45.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462120,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,390.04509,[M-H]-,60.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462121,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462122,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462123,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,426.02177,[M+Cl]-,60.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462124,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,426.02177,[M+Cl]-,15.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462125,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1,426.02177,[M+Cl]-,20.0,val,O=S(=O)(NC1(c2cccs2)CCOCC1)c1ccc(C(F)(F)F)cc1
462126,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,20.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462127,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,20.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462128,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,45.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462129,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,60.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462130,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,20.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462131,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,45.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462132,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,60.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462133,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F,443.03748,[M+H]+,20.0,val,CN(C)C=Nc1cc(=O)n(C2CC2)c(=O)n1-c1ccc(I)cc1F
462134,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,284.12046,[M-H]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462135,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,284.12046,[M-H]-,60.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462136,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,284.12046,[M-H]-,30.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462137,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,284.12046,[M-H]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462138,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,320.09714,[M+Cl]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462139,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462140,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462141,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,60.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462142,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,15.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462143,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462144,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,60.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462145,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,15.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462146,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,330.12594,[M+FA]-,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462147,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,286.13502,[M+H]+,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462148,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,286.13502,[M+H]+,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462149,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,286.13502,[M+H]+,60.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462150,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,286.13502,[M+H]+,30.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462151,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1,286.13502,[M+H]+,20.0,val,Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)ncn1
462152,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,20.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462153,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,20.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462154,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,60.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462155,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,30.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462156,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,20.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462157,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,45.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462158,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,60.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462159,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1,394.04109,[M+H]+,20.0,val,O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1
462160,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462161,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462162,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462163,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462164,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462165,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462166,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462167,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462168,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462169,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462170,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462171,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462172,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462173,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462174,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462175,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462176,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,60.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462177,Cc1ccc(-c2cn3c4c(CCCC4)sc3n2)cc1,269.1107,[M+H]+,20.0,val,Cc1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1
462178,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,20.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462179,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,20.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462180,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,60.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462181,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,20.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462182,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,45.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462183,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,60.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462184,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,20.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462185,COc1ccccc1Nc1nc(-c2c(C)nc(NC(C)=O)s2)cs1,361.07874,[M+H]+,45.0,val,COc1ccccc1Nc1nc(-c2sc(NC(C)=O)nc2C)cs1
462186,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462187,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,60.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462188,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,30.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462189,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462190,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,60.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462191,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,30.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462192,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,319.08549,[M-H]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462193,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,355.06217,[M+Cl]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462194,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,355.06217,[M+Cl]-,15.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462195,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462196,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462197,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,60.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462198,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,15.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462199,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462200,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,60.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462201,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,15.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462202,CC1(NC(=O)c2cc(-c3cc(Cl)ccc3)no2)CCOCC1,365.09097,[M+FA]-,20.0,val,CC1(NC(=O)c2cc(-c3cccc(Cl)c3)no2)CCOCC1
462203,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462204,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462205,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462206,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,30.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462207,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462208,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462209,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,30.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462210,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,319.08549,[M-H]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462211,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,355.06217,[M+Cl]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462212,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462213,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462214,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462215,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462216,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462217,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462218,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462219,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,365.09097,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462220,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462221,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462222,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,60.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462223,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,30.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462224,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462225,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,60.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462226,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,30.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462227,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1,321.10005,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)cn1
462228,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC,321.10005,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC
462229,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC,321.10005,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC
462230,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC,321.10005,[M+H]+,60.0,val,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC
462231,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC,321.10005,[M+H]+,30.0,val,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC
462232,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC,321.10005,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cccnc2Cl)cc1OC
462233,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462234,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462235,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462236,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,30.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462237,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462238,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462239,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,30.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462240,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1,321.10005,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1
462241,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,347.07388,[M-H]-,20.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462242,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,347.07388,[M-H]-,20.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462243,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,347.07388,[M-H]-,60.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462244,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,347.07388,[M-H]-,30.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462245,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,347.07388,[M-H]-,20.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462246,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,347.07388,[M-H]-,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462247,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,347.07388,[M-H]-,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462248,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,347.07388,[M-H]-,60.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462249,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,347.07388,[M-H]-,30.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462250,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,347.07388,[M-H]-,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462251,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,393.07936,[M+FA]-,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462252,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,393.07936,[M+FA]-,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462253,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,393.07936,[M+FA]-,15.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462254,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462255,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462256,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,60.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462257,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,30.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462258,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462259,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,60.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462260,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,30.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462261,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1,349.08844,[M+H]+,20.0,val,O=C(CSc1ccc(N2CCCC2)nn1)Nc1ccc(Cl)cc1
462262,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,349.08844,[M+H]+,15.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462263,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,349.08844,[M+H]+,15.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462264,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,349.08844,[M+H]+,20.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462265,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,349.08844,[M+H]+,60.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462266,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1,349.08844,[M+H]+,15.0,val,Cc1nc2sc(C(c3ccccc3Cl)N3CCCC3)c(O)n2n1
462267,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,20.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462268,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,20.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462269,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,60.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462270,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,30.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462271,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,20.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462272,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,60.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462273,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,30.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462274,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,460.01751,[M-H]-,20.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462275,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,462.03206,[M+H]+,30.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462276,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,462.03206,[M+H]+,30.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462277,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,462.03206,[M+H]+,20.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462278,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,462.03206,[M+H]+,60.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462279,Cc1cc(C(=O)NOCCO)c(Nc2c(F)cc(I)cc2)n(C)c1=O,462.03206,[M+H]+,30.0,val,Cc1cc(C(=O)NOCCO)c(Nc2ccc(I)cc2F)n(C)c1=O
462280,CCC(Sc1c2nnn(-c3ccc(OC)cc3)c2ncn1)C(=O)OC,360.11249,[M+H]+,20.0,val,CCC(Sc1ncnc2c1nnn2-c1ccc(OC)cc1)C(=O)OC
462281,CCC(Sc1c2nnn(-c3ccc(OC)cc3)c2ncn1)C(=O)OC,360.11249,[M+H]+,20.0,val,CCC(Sc1ncnc2c1nnn2-c1ccc(OC)cc1)C(=O)OC
462282,CCC(Sc1c2nnn(-c3ccc(OC)cc3)c2ncn1)C(=O)OC,360.11249,[M+H]+,60.0,val,CCC(Sc1ncnc2c1nnn2-c1ccc(OC)cc1)C(=O)OC
462283,CCC(Sc1c2nnn(-c3ccc(OC)cc3)c2ncn1)C(=O)OC,360.11249,[M+H]+,30.0,val,CCC(Sc1ncnc2c1nnn2-c1ccc(OC)cc1)C(=O)OC
462284,CCC(Sc1c2nnn(-c3ccc(OC)cc3)c2ncn1)C(=O)OC,360.11249,[M+H]+,20.0,val,CCC(Sc1ncnc2c1nnn2-c1ccc(OC)cc1)C(=O)OC
462285,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462286,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462287,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,454.04966,[M-H]-,60.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462288,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,454.04966,[M-H]-,15.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462289,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462290,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462291,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462292,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462293,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462294,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1
462295,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462296,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462297,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462298,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462299,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462300,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462301,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462302,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462303,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462304,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462305,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462306,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462307,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462308,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462309,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462310,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462311,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462312,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462313,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462314,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462315,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,454.04966,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462316,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462317,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462318,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462319,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462320,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462321,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462322,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462323,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462324,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462325,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462326,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462327,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462328,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462329,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462330,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462331,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1,456.06422,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(N)n1
462332,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462333,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462334,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462335,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462336,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462337,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462338,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462339,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462340,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462341,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462342,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462343,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462344,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462345,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462346,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462347,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462348,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462349,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462350,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462351,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462352,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,510.0442,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462353,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462354,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462355,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462356,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462357,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462358,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462359,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462360,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1,512.05875,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CS[C@H]12)c1csc(N)n1
462361,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,334.09639,[M-H]-,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462362,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,334.09639,[M-H]-,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462363,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,334.09639,[M-H]-,60.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462364,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,334.09639,[M-H]-,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462365,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,334.09639,[M-H]-,45.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462366,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,334.09639,[M-H]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462367,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,334.09639,[M-H]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462368,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,334.09639,[M-H]-,60.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462369,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,334.09639,[M-H]-,30.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462370,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,334.09639,[M-H]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462371,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,370.07307,[M+Cl]-,15.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462372,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,370.07307,[M+Cl]-,15.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462373,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,370.07307,[M+Cl]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462374,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,370.07307,[M+Cl]-,60.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462375,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,370.07307,[M+Cl]-,15.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462376,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,380.10187,[M+FA]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462377,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,380.10187,[M+FA]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462378,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,380.10187,[M+FA]-,60.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462379,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,380.10187,[M+FA]-,15.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462380,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,380.10187,[M+FA]-,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462381,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462382,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462383,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,60.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462384,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,30.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462385,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462386,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,60.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462387,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,30.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462388,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,334.09639,[M-H]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462389,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,370.07307,[M+Cl]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462390,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,370.07307,[M+Cl]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462391,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,370.07307,[M+Cl]-,60.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462392,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,370.07307,[M+Cl]-,15.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462393,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,370.07307,[M+Cl]-,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462394,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462395,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462396,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,334.09639,[M-H]-,60.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462397,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,334.09639,[M-H]-,15.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462398,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462399,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462400,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462401,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,60.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462402,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,30.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462403,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462404,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,60.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462405,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,30.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462406,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,334.09639,[M-H]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462407,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,370.07307,[M+Cl]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462408,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,370.07307,[M+Cl]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462409,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,370.07307,[M+Cl]-,60.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462410,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,370.07307,[M+Cl]-,15.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462411,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,370.07307,[M+Cl]-,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462412,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,334.09639,[M-H]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462413,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,334.09639,[M-H]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462414,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,334.09639,[M-H]-,15.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462415,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,370.07307,[M+Cl]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462416,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,370.07307,[M+Cl]-,60.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462417,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,370.07307,[M+Cl]-,15.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462418,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,370.07307,[M+Cl]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462419,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462420,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462421,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,60.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462422,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,15.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462423,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462424,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,60.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462425,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,15.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462426,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,380.10187,[M+FA]-,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462427,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,336.11095,[M+H]+,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462428,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,336.11095,[M+H]+,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462429,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,336.11095,[M+H]+,60.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462430,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,336.11095,[M+H]+,15.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462431,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1,336.11095,[M+H]+,20.0,val,CC(C)(Cc1ccccc1Cl)NC(=O)Cn1ccc(C(=O)O)n1
462432,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462433,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462434,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,336.11095,[M+H]+,60.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462435,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,336.11095,[M+H]+,30.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462436,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCC(NC(=O)C(C)n1cccn1)(C(=O)O)c1ccc(Cl)cc1
462437,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,336.11095,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462438,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,336.11095,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462439,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,336.11095,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462440,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,336.11095,[M+H]+,30.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462441,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cc(Cl)ccc1,336.11095,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC(CC(=O)O)c1cccc(Cl)c1
462442,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462443,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462444,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,336.11095,[M+H]+,60.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462445,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,336.11095,[M+H]+,30.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462446,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1,336.11095,[M+H]+,20.0,val,CCCC(C(=O)NCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1
462447,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,336.11095,[M+H]+,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462448,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,336.11095,[M+H]+,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462449,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,336.11095,[M+H]+,60.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462450,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,336.11095,[M+H]+,30.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462451,COc1c(-c2cc(NC(=O)CC3CCOC3)n[nH]2)cc(Cl)cc1,336.11095,[M+H]+,20.0,val,COc1ccc(Cl)cc1-c1cc(NC(=O)CC2CCOC2)n[nH]1
462452,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,336.11095,[M+H]+,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462453,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,336.11095,[M+H]+,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462454,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,336.11095,[M+H]+,60.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462455,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,336.11095,[M+H]+,30.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462456,O=C(Nc1noc(-c2cc(Cl)ccc2)c1)NC1CCC(O)CC1,336.11095,[M+H]+,20.0,val,O=C(Nc1cc(-c2cccc(Cl)c2)on1)NC1CCC(O)CC1
462457,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1,336.11095,[M+H]+,20.0,val,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1
462458,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1,336.11095,[M+H]+,20.0,val,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1
462459,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1,336.11095,[M+H]+,45.0,val,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1
462460,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1,336.11095,[M+H]+,60.0,val,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1
462461,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1,336.11095,[M+H]+,20.0,val,O=C(C1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1
462462,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,424.08518,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462463,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,424.08518,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462464,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,424.08518,[M+FA]-,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462465,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,424.08518,[M+FA]-,15.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462466,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,424.08518,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462467,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462468,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462469,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,30.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462470,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462471,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,15.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462472,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462473,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462474,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2,380.09425,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)N1CC(Cn3cc(Cl)cn3)C1)CS2
462475,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,418.01913,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462476,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,418.01913,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462477,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,418.01913,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462478,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,418.01913,[M-H]-,15.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462479,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,418.01913,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462480,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462481,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462482,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,60.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462483,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,15.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462484,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462485,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,60.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462486,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462487,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,464.02461,[M+FA]-,15.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462488,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,420.03368,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462489,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,420.03368,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462490,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,420.03368,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462491,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,420.03368,[M+H]+,15.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462492,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl,420.03368,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCC(S(=O)(=O)Cc3ccco3)C2)cc1Cl
462493,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,20.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462494,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,20.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462495,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,60.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462496,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,20.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462497,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,60.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462498,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1,338.15871,[M+H]+,20.0,val,Cc1cc(CNc2nccc(C(F)(F)F)n2)cc(N2CCCC2)n1
462499,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C,338.15871,[M+H]+,20.0,val,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C
462500,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C,338.15871,[M+H]+,20.0,val,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C
462501,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C,338.15871,[M+H]+,45.0,val,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C
462502,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C,338.15871,[M+H]+,60.0,val,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C
462503,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C,338.15871,[M+H]+,20.0,val,Cc1ncnc(N2CCN(c3ccc(C(F)(F)F)nc3)CC2)c1C
462504,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,20.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462505,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,20.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462506,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,60.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462507,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,20.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462508,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,45.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462509,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,60.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462510,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,20.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462511,O=C(c1c2CCCCn2c(C(F)(F)F)n1)N1CCN(c2nccs2)CC1,386.12569,[M+H]+,45.0,val,O=C(c1nc(C(F)(F)F)n2c1CCCC2)N1CCN(c2nccs2)CC1
462512,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,384.11114,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462513,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,384.11114,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462514,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,384.11114,[M-H]-,60.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462515,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,384.11114,[M-H]-,15.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462516,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,384.11114,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462517,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,386.12569,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462518,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,386.12569,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462519,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,386.12569,[M+H]+,60.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462520,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,386.12569,[M+H]+,15.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462521,CCCc1c(C(=O)NCCc2nc(C3CC3)cc(C(F)(F)F)n2)snn1,386.12569,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCCc1nc(C2CC2)cc(C(F)(F)F)n1
462522,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,354.08486,[M+Cl]-,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462523,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,354.08486,[M+Cl]-,15.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462524,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,364.11366,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462525,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,364.11366,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462526,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,364.11366,[M+FA]-,60.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462527,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,364.11366,[M+FA]-,15.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462528,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,364.11366,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462529,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462530,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462531,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,45.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462532,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,60.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462533,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462534,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,60.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462535,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,45.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462536,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1,320.12274,[M+H]+,20.0,val,O=C(CCc1ccccc1F)NC1CCN(c2nccs2)C1
462537,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462538,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462539,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,60.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462540,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,15.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462541,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462542,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,45.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462543,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,60.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462544,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1,320.12274,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2cccc(F)c2)c(N2CCSCC2)n1
462545,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462546,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462547,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462548,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462549,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462550,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,314.14226,[M-H]-,60.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462551,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,350.11894,[M+Cl]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462552,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,350.11894,[M+Cl]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462553,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,350.11894,[M+Cl]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462554,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462555,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462556,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,60.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462557,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462558,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462559,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462560,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462561,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,360.14774,[M+FA]-,60.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462562,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,20.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462563,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,20.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462564,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,45.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462565,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,60.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462566,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,20.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462567,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,45.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462568,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,60.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462569,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1,316.15681,[M+H]+,20.0,val,Cc1cnc(C(=O)N2CCN(c3ncncc3C)CC2)c(F)c1
462570,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,316.15681,[M+H]+,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462571,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,316.15681,[M+H]+,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462572,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,316.15681,[M+H]+,60.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462573,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,316.15681,[M+H]+,15.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462574,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1,316.15681,[M+H]+,20.0,val,CCCCn1nnnc1NCc1ccc(-c2ccc(F)cc2)o1
462575,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,20.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462576,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,20.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462577,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,45.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462578,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,60.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462579,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,20.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462580,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,60.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462581,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,45.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462582,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12,351.17887,[M+H]+,20.0,val,Cc1nnc2ccc(N3CCN(c4ncnc5c4ncn5C)CC3)nn12
462583,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462584,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462585,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,60.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462586,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,30.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462587,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462588,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,60.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462589,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,30.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462590,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462591,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462592,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462593,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,60.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462594,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,30.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462595,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1,271.12635,[M+H]+,20.0,val,CSC(=Nc1ccc(C)cc1)Nc1ccc(C)cc1
462596,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462597,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462598,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462599,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462600,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462601,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462602,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462603,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462604,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462605,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462606,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462607,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462608,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462609,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462610,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462611,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462612,CN(C)c1cc2c(cc1)nc1ccc(=[N+](C)C)cc-1s2,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462613,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462614,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462615,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462616,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462617,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,60.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462618,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1,284.1216,[M]+,20.0,val,CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1
462619,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,297.1357,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462620,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,297.1357,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462621,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,297.1357,[M-H]-,60.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462622,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,297.1357,[M-H]-,30.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462623,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,297.1357,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462624,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,297.1357,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462625,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,297.1357,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462626,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,297.1357,[M-H]-,60.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462627,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,297.1357,[M-H]-,30.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462628,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,297.1357,[M-H]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462629,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,343.14118,[M+FA]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462630,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,343.14118,[M+FA]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462631,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,343.14118,[M+FA]-,60.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462632,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,343.14118,[M+FA]-,15.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462633,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,343.14118,[M+FA]-,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462634,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,297.1357,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462635,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,297.1357,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462636,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,297.1357,[M-H]-,60.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462637,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,297.1357,[M-H]-,30.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462638,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,297.1357,[M-H]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462639,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,333.11238,[M+Cl]-,15.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462640,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,333.11238,[M+Cl]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462641,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,343.14118,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462642,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,343.14118,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462643,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,343.14118,[M+FA]-,60.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462644,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,343.14118,[M+FA]-,15.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462645,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,343.14118,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462646,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,20.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462647,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,20.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462648,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,60.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462649,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,20.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462650,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,75.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462651,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,60.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462652,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,20.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462653,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cnccc2)n1,299.15025,[M+H]+,75.0,val,Cc1cc(N2CC3COCC(C2)O3)nc(-c2cccnc2)n1
462654,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1,299.15025,[M+H]+,20.0,val,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1
462655,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1,299.15025,[M+H]+,20.0,val,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1
462656,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1,299.15025,[M+H]+,60.0,val,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1
462657,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1,299.15025,[M+H]+,15.0,val,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1
462658,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1,299.15025,[M+H]+,20.0,val,CN(Cc1cccc(=O)[nH]1)C(=O)Nc1cccc(C2CC2)n1
462659,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462660,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462661,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,60.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462662,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462663,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,45.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462664,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,60.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462665,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,20.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462666,NC(=O)C1(O)CCN(c2nc(-c3ccccc3)ncc2)CC1,299.15025,[M+H]+,45.0,val,NC(=O)C1(O)CCN(c2ccnc(-c3ccccc3)n2)CC1
462667,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462668,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462669,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,60.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462670,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,30.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462671,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462672,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,60.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462673,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,30.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462674,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(Cc1noc(C2CC23CCNC3)n1)Nc1ccccc1
462675,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,20.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462676,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,20.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462677,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,60.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462678,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,30.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462679,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,20.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462680,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,60.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462681,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,30.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462682,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1,299.15025,[M+H]+,20.0,val,Cc1cnc(NCCN2Cc3ccccc3OCC2=O)nc1
462683,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462684,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462685,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,30.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462686,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462687,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,15.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462688,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462689,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,60.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462690,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1,299.15025,[M+H]+,20.0,val,Cc1n[nH]c(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
462691,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,60.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462692,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,60.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462693,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,20.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462694,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,60.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462695,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,45.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462696,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,20.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462697,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1,299.15025,[M+H]+,60.0,val,O=C1NCCC1(c1nc(-c2ccncc2)no1)C1CCCC1
462698,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,20.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462699,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,20.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462700,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,30.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462701,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,60.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462702,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,15.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462703,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,20.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462704,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,60.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462705,O=c1c2c(cnn1CCN1CCOCC1)c1ccccc1[nH]2,299.15025,[M+H]+,20.0,val,O=c1c2[nH]c3ccccc3c2cnn1CCN1CCOCC1
462706,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,20.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462707,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,20.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462708,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,60.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462709,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,20.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462710,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,45.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462711,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,60.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462712,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,20.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462713,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1,299.15025,[M+H]+,45.0,val,O=C(NC12CCCC1NCC2)c1coc(-c2ccccn2)n1
462714,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,299.15025,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462715,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,299.15025,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462716,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,299.15025,[M+H]+,60.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462717,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,299.15025,[M+H]+,15.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462718,O=C(Nc1cn(Cc2ccncc2)nc1)C1CC12CCOC2,299.15025,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccncc2)c1)C1CC12CCOC2
462719,CC(C)[C@@H](C(=O)Nc1c[nH]nc1)N1Cc2ccccc2C1=O,299.15025,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)Nc1cn[nH]c1)N1Cc2ccccc2C1=O
462720,CC(C)[C@@H](C(=O)Nc1c[nH]nc1)N1Cc2ccccc2C1=O,299.15025,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)Nc1cn[nH]c1)N1Cc2ccccc2C1=O
462721,CC(C)[C@@H](C(=O)Nc1c[nH]nc1)N1Cc2ccccc2C1=O,299.15025,[M+H]+,60.0,val,CC(C)[C@@H](C(=O)Nc1cn[nH]c1)N1Cc2ccccc2C1=O
462722,CC(C)[C@@H](C(=O)Nc1c[nH]nc1)N1Cc2ccccc2C1=O,299.15025,[M+H]+,15.0,val,CC(C)[C@@H](C(=O)Nc1cn[nH]c1)N1Cc2ccccc2C1=O
462723,CC(C)[C@@H](C(=O)Nc1c[nH]nc1)N1Cc2ccccc2C1=O,299.15025,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)Nc1cn[nH]c1)N1Cc2ccccc2C1=O
462724,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1,299.15025,[M+H]+,20.0,val,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1
462725,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1,299.15025,[M+H]+,20.0,val,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1
462726,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1,299.15025,[M+H]+,60.0,val,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1
462727,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1,299.15025,[M+H]+,30.0,val,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1
462728,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1,299.15025,[M+H]+,20.0,val,O=C(c1cccc(Cn2ccnn2)c1)N1C[C@H]2COC[C@H]2C1
462729,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,297.1357,[M-H]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462730,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,297.1357,[M-H]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462731,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,297.1357,[M-H]-,60.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462732,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,297.1357,[M-H]-,30.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462733,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,297.1357,[M-H]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462734,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,333.11238,[M+Cl]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462735,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,333.11238,[M+Cl]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462736,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,333.11238,[M+Cl]-,15.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462737,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,333.11238,[M+Cl]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462738,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,343.14118,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462739,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,343.14118,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462740,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,343.14118,[M+FA]-,60.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462741,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,343.14118,[M+FA]-,15.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462742,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,343.14118,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462743,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,297.1357,[M-H]-,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462744,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,297.1357,[M-H]-,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462745,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,297.1357,[M-H]-,60.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462746,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,297.1357,[M-H]-,15.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462747,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,297.1357,[M-H]-,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462748,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462749,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462750,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,30.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462751,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,60.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462752,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,15.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462753,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462754,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,60.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462755,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1,299.15025,[M+H]+,20.0,val,O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
462756,COCc1cc(-c2cc3c(nc2)N(C(N)=O)CCC3)cnc1,299.15025,[M+H]+,20.0,val,COCc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
462757,COCc1cc(-c2cc3c(nc2)N(C(N)=O)CCC3)cnc1,299.15025,[M+H]+,20.0,val,COCc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
462758,COCc1cc(-c2cc3c(nc2)N(C(N)=O)CCC3)cnc1,299.15025,[M+H]+,60.0,val,COCc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
462759,COCc1cc(-c2cc3c(nc2)N(C(N)=O)CCC3)cnc1,299.15025,[M+H]+,30.0,val,COCc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
462760,COCc1cc(-c2cc3c(nc2)N(C(N)=O)CCC3)cnc1,299.15025,[M+H]+,20.0,val,COCc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
462761,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,299.15025,[M+H]+,15.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462762,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,299.15025,[M+H]+,15.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462763,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,299.15025,[M+H]+,20.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462764,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,299.15025,[M+H]+,60.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462765,O=C(NCC(=O)N1CCCC1)Nc1cc2c(cc1)cncc2,299.15025,[M+H]+,15.0,val,O=C(NCC(=O)N1CCCC1)Nc1ccc2cnccc2c1
462766,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462767,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462768,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,15.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462769,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,60.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462770,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,30.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462771,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462772,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,60.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462773,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462774,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462775,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462776,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,60.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462777,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,30.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462778,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462779,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,60.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462780,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,30.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462781,c1cnc(N2CCN(Cc3cc4c(cc3)OCO4)CC2)nc1,299.15025,[M+H]+,20.0,val,c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1
462782,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,20.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462783,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,20.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462784,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,60.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462785,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,30.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462786,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,20.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462787,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,60.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462788,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,30.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462789,CN1CCN(c2nc(-c3ccccc3)cc(C(=O)O)n2)CC1,299.15025,[M+H]+,20.0,val,CN1CCN(c2nc(C(=O)O)cc(-c3ccccc3)n2)CC1
462790,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462791,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462792,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,30.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462793,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462794,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462795,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,45.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462796,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462797,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,425.04174,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462798,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,427.05629,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462799,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,427.05629,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462800,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,427.05629,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462801,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,427.05629,[M+H]+,30.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462802,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1,427.05629,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCC(=O)N2S(=O)(=O)c2ccc(C)cc2)s1
462803,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1
462804,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1
462805,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1,327.13864,[M+H]+,60.0,val,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1
462806,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1
462807,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1,327.13864,[M+H]+,45.0,val,c1nc(N2CCC(c3nncn3C3CC3)CC2)c2ccsc2n1
462808,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462809,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462810,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,60.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462811,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462812,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,45.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462813,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,60.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462814,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,20.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462815,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1,327.13864,[M+H]+,45.0,val,CCc1nc(N2CCN(c3ncccn3)CC2)c2ccsc2n1
462816,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462817,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462818,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,45.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462819,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,60.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462820,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462821,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,45.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462822,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,60.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462823,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,325.12409,[M-H]-,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462824,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462825,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462826,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,60.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462827,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,30.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462828,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462829,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,30.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462830,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,60.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462831,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12,327.13864,[M+H]+,20.0,val,CCN(CC)Cc1nnc2sc(-c3c[nH]c4ccccc34)nn12
462832,COc1cc(CCc2cc(O)c(OC)cc2)cc(O)c1,273.11323,[M-H]-,20.0,val,COc1cc(O)cc(CCc2ccc(OC)c(O)c2)c1
462833,COc1cc(CCc2cc(O)c(OC)cc2)cc(O)c1,273.11323,[M-H]-,20.0,val,COc1cc(O)cc(CCc2ccc(OC)c(O)c2)c1
462834,COc1cc(CCc2cc(O)c(OC)cc2)cc(O)c1,273.11323,[M-H]-,60.0,val,COc1cc(O)cc(CCc2ccc(OC)c(O)c2)c1
462835,COc1cc(CCc2cc(O)c(OC)cc2)cc(O)c1,273.11323,[M-H]-,30.0,val,COc1cc(O)cc(CCc2ccc(OC)c(O)c2)c1
462836,COc1cc(CCc2cc(O)c(OC)cc2)cc(O)c1,273.11323,[M-H]-,20.0,val,COc1cc(O)cc(CCc2ccc(OC)c(O)c2)c1
462837,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O,273.11323,[M-H]-,20.0,val,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O
462838,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O,273.11323,[M-H]-,20.0,val,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O
462839,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O,273.11323,[M-H]-,60.0,val,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O
462840,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O,273.11323,[M-H]-,20.0,val,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O
462841,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O,273.11323,[M-H]-,45.0,val,CC1=C(O)C(=O)C23CC(=O)CCC2C=CC(C)C3C1=O
462842,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462843,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462844,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,60.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462845,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,30.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462846,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462847,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,60.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462848,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,30.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462849,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O,275.12779,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O
462850,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,20.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462851,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,20.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462852,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,45.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462853,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,60.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462854,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,20.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462855,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,20.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462856,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,60.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462857,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C,275.12779,[M+H]+,45.0,val,COc1cc2oc(=O)ccc2c(OC)c1CC=C(C)C
462858,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462859,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462860,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462861,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462862,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462863,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462864,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462865,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462866,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462867,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462868,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462869,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462870,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462871,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462872,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462873,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462874,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462875,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462876,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462877,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462878,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462879,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462880,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462881,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
462882,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462883,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462884,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,15.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462885,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462886,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,30.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462887,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462888,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,60.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462889,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1,275.13095,[M+H]+,20.0,val,CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
462890,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,381.07936,[M-H]-,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462891,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,381.07936,[M-H]-,60.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462892,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,381.07936,[M-H]-,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462893,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,427.08484,[M+FA]-,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462894,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,427.08484,[M+FA]-,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462895,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,427.08484,[M+FA]-,60.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462896,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,427.08484,[M+FA]-,15.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462897,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,427.08484,[M+FA]-,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462898,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,383.09391,[M+H]+,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462899,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,383.09391,[M+H]+,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462900,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,383.09391,[M+H]+,60.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462901,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,383.09391,[M+H]+,30.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462902,O=C(NCCn1cccn1)c1c(Cl)cc(N2CCCCS2(=O)=O)cc1,383.09391,[M+H]+,20.0,val,O=C(NCCn1cccn1)c1ccc(N2CCCCS2(=O)=O)cc1Cl
462903,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1,359.1494,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1
462904,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1,359.1494,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1
462905,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1,359.1494,[M+H]+,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1
462906,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1,359.1494,[M+H]+,30.0,val,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1
462907,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1,359.1494,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(c2ncnc3c2ncn3C)CC1
462908,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,317.14193,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462909,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,317.14193,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462910,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,317.14193,[M-H]-,60.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462911,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,317.14193,[M-H]-,30.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462912,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,317.14193,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462913,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,363.14741,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462914,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,363.14741,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462915,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,363.14741,[M+FA]-,60.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462916,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,363.14741,[M+FA]-,15.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462917,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,363.14741,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462918,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,317.14193,[M-H]-,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462919,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,317.14193,[M-H]-,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462920,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,317.14193,[M-H]-,60.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462921,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,317.14193,[M-H]-,30.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462922,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,317.14193,[M-H]-,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462923,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462924,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,60.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462925,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,15.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462926,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462927,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,60.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462928,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,15.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462929,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,363.14741,[M+FA]-,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462930,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,353.11861,[M+Cl]-,15.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462931,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,353.11861,[M+Cl]-,15.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462932,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,363.14741,[M+FA]-,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462933,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,363.14741,[M+FA]-,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462934,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,363.14741,[M+FA]-,60.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462935,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,363.14741,[M+FA]-,15.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462936,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,363.14741,[M+FA]-,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462937,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462938,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462939,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,30.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462940,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,60.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462941,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462942,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,45.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462943,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,60.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462944,CC1(NC(=O)NCc2cc(F)c(-n3ccnc3)cc2)CCOC1,319.15648,[M+H]+,20.0,val,CC1(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCOC1
462945,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,319.15648,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462946,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,319.15648,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462947,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,319.15648,[M+H]+,60.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462948,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,319.15648,[M+H]+,30.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462949,O=C(Nc1cn(-c2ccccc2F)nc1)NC1CCC(O)CC1,319.15648,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ccccc2F)c1)NC1CCC(O)CC1
462950,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,20.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462951,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,20.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462952,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,60.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462953,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,30.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462954,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,20.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462955,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,60.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462956,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,30.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462957,Cc1cc(N2CCC(Oc3c(F)cccn3)CC2)nc(CO)n1,319.15648,[M+H]+,20.0,val,Cc1cc(N2CCC(Oc3ncccc3F)CC2)nc(CO)n1
462958,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462959,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462960,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,60.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462961,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,30.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462962,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462963,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,60.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462964,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,30.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462965,CCn1cnnc1NC(=O)C1(c2cc(F)ccc2)CCOCC1,319.15648,[M+H]+,20.0,val,CCn1cnnc1NC(=O)C1(c2cccc(F)c2)CCOCC1
462966,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,20.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462967,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,20.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462968,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,60.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462969,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,30.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462970,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,20.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462971,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,60.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462972,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,30.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462973,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1,319.15648,[M+H]+,20.0,val,Cn1nc(NC(=O)N2CCCC2CO)cc1-c1ccc(F)cc1
462974,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,20.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462975,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,20.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462976,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,60.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462977,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,20.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462978,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,45.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462979,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,60.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462980,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,20.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462981,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O,319.15648,[M+H]+,45.0,val,Cn1c(N2CCN(c3ccccc3F)CC2)cc(=O)n(C)c1=O
462982,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462983,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462984,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,60.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462985,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,30.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462986,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462987,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,60.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462988,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,30.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462989,Cc1c(C(O)Cn2cc(CN3CCCC3=O)nn2)ccc(F)c1,319.15648,[M+H]+,20.0,val,Cc1cc(F)ccc1C(O)Cn1cc(CN2CCCC2=O)nn1
462990,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,333.09695,[M]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462991,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,333.09695,[M]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462992,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,333.09695,[M]+,60.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462993,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,333.09695,[M]+,30.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462994,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,333.09695,[M]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462995,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,334.10423,[M+H]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462996,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,334.10423,[M+H]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462997,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,334.10423,[M+H]+,60.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462998,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,334.10423,[M+H]+,30.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
462999,CSCc1cnc(CNc2cc3c(cc2)NC(=O)CCC3)s1,334.10423,[M+H]+,20.0,val,CSCc1cnc(CNc2ccc3c(c2)CCCC(=O)N3)s1
463000,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463001,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463002,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463003,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,15.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463004,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463005,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463006,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,15.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463007,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463008,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463009,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463010,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,334.10423,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463011,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,334.10423,[M+H]+,15.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463012,Cc1cc(NC(=S)NNC(=O)c2csc(C)c2C)c(C)cc1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463013,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463014,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463015,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,332.08968,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463016,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,332.08968,[M-H]-,30.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463017,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,332.08968,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463018,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463019,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463020,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,45.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463021,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463022,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463023,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,45.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463024,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463025,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,332.08968,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463026,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463027,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463028,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,332.08968,[M-H]-,60.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463029,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,332.08968,[M-H]-,30.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463030,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463031,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463032,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463033,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,60.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463034,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,30.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463035,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463036,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463037,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,30.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463038,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,332.08968,[M-H]-,60.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463039,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463040,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463041,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,60.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463042,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,15.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463043,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463044,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463045,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,60.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463046,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C,334.10423,[M+H]+,15.0,val,CCc1c(C(=O)NNC(=S)NCc2ccccc2)csc1C
463047,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463048,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463049,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,334.10423,[M+H]+,60.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463050,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,334.10423,[M+H]+,15.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463051,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C,334.10423,[M+H]+,20.0,val,CCc1c(C(=O)NNC(=S)Nc2ccccc2C)csc1C
463052,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463053,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463054,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,30.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463055,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463056,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463057,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,45.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463058,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463059,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1,334.10423,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2(c3ccccc3)CCCC2)s1
463060,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463061,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463062,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,334.10423,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463063,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,334.10423,[M+H]+,15.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463064,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1,334.10423,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=S)NNC(=O)c2csc(C)c2C)c1
463065,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,320.07844,[M-H]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463066,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,320.07844,[M-H]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463067,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,320.07844,[M-H]-,60.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463068,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,320.07844,[M-H]-,30.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463069,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,320.07844,[M-H]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463070,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,366.08392,[M+FA]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463071,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,366.08392,[M+FA]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463072,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,366.08392,[M+FA]-,60.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463073,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,366.08392,[M+FA]-,15.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463074,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,366.08392,[M+FA]-,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463075,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,320.07844,[M-H]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463076,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,320.07844,[M-H]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463077,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,320.07844,[M-H]-,60.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463078,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,320.07844,[M-H]-,30.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463079,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,320.07844,[M-H]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463080,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,366.08392,[M+FA]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463081,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,366.08392,[M+FA]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463082,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,366.08392,[M+FA]-,60.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463083,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,366.08392,[M+FA]-,15.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463084,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,366.08392,[M+FA]-,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463085,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,20.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463086,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,20.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463087,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,60.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463088,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,30.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463089,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,20.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463090,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,20.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463091,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,30.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463092,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1,322.093,[M+H]+,60.0,val,O=C(Cc1cccs1)NCC1(c2cccs2)CCOCC1
463093,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1,322.093,[M+H]+,30.0,val,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1
463094,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1,322.093,[M+H]+,30.0,val,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1
463095,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1,322.093,[M+H]+,20.0,val,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1
463096,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1,322.093,[M+H]+,60.0,val,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1
463097,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1,322.093,[M+H]+,30.0,val,O=C(NCCc1ccc(-c2ccsc2)s1)C1CCOCC1
463098,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463099,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463100,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,15.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463101,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,60.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463102,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,30.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463103,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463104,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,20.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463105,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1,322.093,[M+H]+,60.0,val,CSCCC(O)CNC(=O)c1ccc(-c2ccsc2)cc1
463106,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1,322.093,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1
463107,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1,322.093,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1
463108,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1,322.093,[M+H]+,60.0,val,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1
463109,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1,322.093,[M+H]+,30.0,val,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1
463110,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1,322.093,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)N2CCC(c3cccs3)C2)c1
463111,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,322.093,[M+H]+,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463112,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,322.093,[M+H]+,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463113,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,322.093,[M+H]+,60.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463114,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,322.093,[M+H]+,15.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463115,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1,322.093,[M+H]+,20.0,val,Cc1csc(C(=O)NC(c2cccs2)C2CCOCC2)c1
463116,COc1c(Br)cc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1,430.04307,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1Br
463117,COc1c(Br)cc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1,430.04307,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1Br
463118,COc1c(Br)cc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1,430.04307,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1Br
463119,COc1c(Br)cc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1,430.04307,[M+H]+,15.0,val,COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1Br
463120,COc1c(Br)cc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1,430.04307,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCCC2)cc1Br
463121,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,20.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463122,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,20.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463123,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,45.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463124,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,60.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463125,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,20.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463126,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,45.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463127,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,60.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463128,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1,386.07582,[M+H]+,20.0,val,O=S(=O)(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1cccs1
463129,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,20.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463130,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,20.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463131,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,60.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463132,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,30.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463133,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,20.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463134,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,60.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463135,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,30.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463136,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1,350.13783,[M+H]+,20.0,val,COC(=O)C1CCN(c2nnnn2CCc2ccc(Cl)cc2)CC1
463137,Cn1cnnc1NC(=O)CSc1c(N2CCCCC2)c(Cl)ccc1,366.11498,[M+H]+,20.0,val,Cn1cnnc1NC(=O)CSc1cccc(Cl)c1N1CCCCC1
463138,Cn1cnnc1NC(=O)CSc1c(N2CCCCC2)c(Cl)ccc1,366.11498,[M+H]+,20.0,val,Cn1cnnc1NC(=O)CSc1cccc(Cl)c1N1CCCCC1
463139,Cn1cnnc1NC(=O)CSc1c(N2CCCCC2)c(Cl)ccc1,366.11498,[M+H]+,60.0,val,Cn1cnnc1NC(=O)CSc1cccc(Cl)c1N1CCCCC1
463140,Cn1cnnc1NC(=O)CSc1c(N2CCCCC2)c(Cl)ccc1,366.11498,[M+H]+,30.0,val,Cn1cnnc1NC(=O)CSc1cccc(Cl)c1N1CCCCC1
463141,Cn1cnnc1NC(=O)CSc1c(N2CCCCC2)c(Cl)ccc1,366.11498,[M+H]+,20.0,val,Cn1cnnc1NC(=O)CSc1cccc(Cl)c1N1CCCCC1
463142,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1,342.09252,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1
463143,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1,342.09252,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1
463144,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1,342.09252,[M+H]+,20.0,val,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1
463145,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1,342.09252,[M+H]+,60.0,val,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1
463146,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1,342.09252,[M+H]+,30.0,val,O=C(C1CCC1)N1CCC(c2ccccc2Cl)S(=O)(=O)CC1
463147,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F,335.17903,[M+H]+,20.0,val,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F
463148,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F,335.17903,[M+H]+,20.0,val,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F
463149,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F,335.17903,[M+H]+,45.0,val,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F
463150,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F,335.17903,[M+H]+,60.0,val,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F
463151,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F,335.17903,[M+H]+,20.0,val,CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F
463152,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463153,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463154,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,60.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463155,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463156,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,45.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463157,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,60.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463158,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463159,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,314.13734,[M-H]-,45.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463160,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,360.14282,[M+FA]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463161,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,360.14282,[M+FA]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463162,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,360.14282,[M+FA]-,60.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463163,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,360.14282,[M+FA]-,15.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463164,CC(C)(NC(=O)c1cc(F)c(C(F)F)cc1)C1CCOCC1,360.14282,[M+FA]-,20.0,val,CC(C)(NC(=O)c1ccc(C(F)F)c(F)c1)C1CCOCC1
463165,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,20.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463166,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,20.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463167,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,60.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463168,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,30.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463169,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,20.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463170,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,30.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463171,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,20.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463172,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1,316.15189,[M+H]+,60.0,val,O=C(CCc1ccccc1)N(CC(F)(F)F)C1CCOCC1
463173,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,357.16806,[M+FA]-,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463174,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,357.16806,[M+FA]-,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463175,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,357.16806,[M+FA]-,60.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463176,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,357.16806,[M+FA]-,15.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463177,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,357.16806,[M+FA]-,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463178,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463179,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463180,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,60.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463181,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463182,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,45.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463183,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,60.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463184,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463185,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,311.16258,[M-H]-,45.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463186,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,347.13926,[M+Cl]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463187,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,347.13926,[M+Cl]-,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463188,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,347.13926,[M+Cl]-,60.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463189,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,347.13926,[M+Cl]-,15.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463190,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,357.16806,[M+FA]-,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463191,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,357.16806,[M+FA]-,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463192,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,357.16806,[M+FA]-,60.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463193,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,357.16806,[M+FA]-,15.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463194,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,357.16806,[M+FA]-,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463195,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463196,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463197,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,60.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463198,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463199,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,45.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463200,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,60.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463201,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463202,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,311.16258,[M-H]-,45.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463203,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,347.13926,[M+Cl]-,15.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463204,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,347.13926,[M+Cl]-,15.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463205,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,347.13926,[M+Cl]-,60.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463206,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463207,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463208,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,60.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463209,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,30.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463210,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463211,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,60.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463212,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,30.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463213,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1,313.17713,[M+H]+,20.0,val,CNC(=O)NC1CN(c2nc(-c3ccncc3)nc(C)c2C)C1
463214,Cc1nc2c(-c3noc(CCC4CCNC4)n3)cnn2c(C)c1,313.17713,[M+H]+,30.0,val,Cc1cc(C)n2ncc(-c3noc(CCC4CCNC4)n3)c2n1
463215,Cc1nc2c(-c3noc(CCC4CCNC4)n3)cnn2c(C)c1,313.17713,[M+H]+,30.0,val,Cc1cc(C)n2ncc(-c3noc(CCC4CCNC4)n3)c2n1
463216,Cc1nc2c(-c3noc(CCC4CCNC4)n3)cnn2c(C)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)n2ncc(-c3noc(CCC4CCNC4)n3)c2n1
463217,Cc1nc2c(-c3noc(CCC4CCNC4)n3)cnn2c(C)c1,313.17713,[M+H]+,60.0,val,Cc1cc(C)n2ncc(-c3noc(CCC4CCNC4)n3)c2n1
463218,Cc1nc2c(-c3noc(CCC4CCNC4)n3)cnn2c(C)c1,313.17713,[M+H]+,30.0,val,Cc1cc(C)n2ncc(-c3noc(CCC4CCNC4)n3)c2n1
463219,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463220,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463221,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,60.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463222,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,30.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463223,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463224,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,60.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463225,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,30.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463226,C[C@@H]1CN(Cc2cn(-c3cc4c(cc3)nc[nH]4)nn2)C[C@H](C)O1,313.17713,[M+H]+,20.0,val,C[C@@H]1CN(Cc2cn(-c3ccc4nc[nH]c4c3)nn2)C[C@H](C)O1
463227,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,20.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463228,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,20.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463229,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,60.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463230,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,30.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463231,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,20.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463232,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,60.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463233,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,30.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463234,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1,313.17713,[M+H]+,20.0,val,CNc1nc(C)cc(C(=O)N2CCN(c3ccccn3)CC2)n1
463235,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463236,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463237,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,60.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463238,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,30.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463239,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463240,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,60.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463241,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,30.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463242,NC(=O)c1c(N2CCC(c3nnc4CCCn43)CC2)ccnc1,313.17713,[M+H]+,20.0,val,NC(=O)c1cnccc1N1CCC(c2nnc3n2CCC3)CC1
463243,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463244,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463245,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,60.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463246,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,30.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463247,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463248,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,60.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463249,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,30.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463250,COc1nc2c(cc1)[nH]c(CN1CCC(c3ncc[nH]3)CC1)n2,313.17713,[M+H]+,20.0,val,COc1ccc2[nH]c(CN3CCC(c4ncc[nH]4)CC3)nc2n1
463251,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463252,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463253,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463254,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463255,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463256,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463257,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463258,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463259,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463260,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463261,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463262,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463263,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463264,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463265,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463266,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463267,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463268,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463269,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463270,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463271,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463272,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463273,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463274,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463275,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463276,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463277,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,60.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463278,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,20.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463279,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1c2cc[nH]c2ncn1,313.17713,[M+H]+,45.0,val,C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12
463280,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463281,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463282,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463283,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,30.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463284,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463285,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463286,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,30.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463287,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463288,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463289,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463290,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,357.16806,[M+FA]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463291,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,357.16806,[M+FA]-,15.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463292,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463293,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463294,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463295,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,313.17713,[M+H]+,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463296,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,313.17713,[M+H]+,30.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463297,Cc1nn(C)c(C)c1-c1n[nH]c(C(=O)NCCn2cccc2)c1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463298,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463299,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463300,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463301,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463302,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,45.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463303,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463304,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463305,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463306,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463307,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463308,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463309,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463310,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,45.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463311,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463312,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463313,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,45.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463314,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463315,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463316,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,30.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463317,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463318,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463319,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,311.16258,[M-H]-,30.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463320,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,357.16806,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463321,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,357.16806,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463322,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,357.16806,[M+FA]-,60.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463323,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,357.16806,[M+FA]-,15.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463324,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,357.16806,[M+FA]-,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463325,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463326,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463327,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,45.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463328,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463329,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463330,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463331,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,45.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463332,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,311.16258,[M-H]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463333,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,347.13926,[M+Cl]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463334,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,347.13926,[M+Cl]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463335,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,347.13926,[M+Cl]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463336,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,347.13926,[M+Cl]-,15.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463337,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463338,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463339,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,357.16806,[M+FA]-,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463340,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,357.16806,[M+FA]-,15.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463341,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,357.16806,[M+FA]-,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463342,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463343,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463344,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,45.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463345,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,60.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463346,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463347,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463348,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,45.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463349,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,311.16258,[M-H]-,60.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463350,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463351,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463352,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,15.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463353,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,60.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463354,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,30.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463355,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463356,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463357,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,311.16258,[M-H]-,60.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463358,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,347.13926,[M+Cl]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463359,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,347.13926,[M+Cl]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463360,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,347.13926,[M+Cl]-,15.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463361,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,347.13926,[M+Cl]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463362,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463363,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463364,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,60.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463365,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,15.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463366,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463367,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,15.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463368,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463369,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,357.16806,[M+FA]-,60.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463370,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463371,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463372,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,45.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463373,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463374,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463375,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,45.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463376,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463377,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,311.16258,[M-H]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463378,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463379,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463380,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463381,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,15.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463382,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,357.16806,[M+FA]-,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463383,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,295.16657,[M+H-H2O]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463384,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,295.16657,[M+H-H2O]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463385,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,295.16657,[M+H-H2O]+,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463386,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,295.16657,[M+H-H2O]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463387,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,295.16657,[M+H-H2O]+,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463388,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463389,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463390,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,313.17713,[M+H]+,60.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463391,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,313.17713,[M+H]+,30.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463392,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1,313.17713,[M+H]+,20.0,val,Cc1nn(C)c(C)c1-c1cc(C(=O)NCCn2cccc2)[nH]n1
463393,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463394,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463395,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463396,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463397,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,60.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463398,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1,313.17713,[M+H]+,20.0,val,Cc1cc(C)cc(Nc2nc(NCCO)c3cnn(C)c3n2)c1
463399,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463400,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463401,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,45.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463402,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,60.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463403,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463404,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,45.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463405,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,60.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463406,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1,313.17713,[M+H]+,20.0,val,COc1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)ncn1
463407,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463408,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463409,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,45.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463410,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,60.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463411,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463412,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,45.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463413,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,20.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463414,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1,313.17713,[M+H]+,60.0,val,COc1ccnc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1
463415,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463416,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463417,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,45.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463418,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,60.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463419,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463420,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,60.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463421,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1,313.17713,[M+H]+,20.0,val,CN(C)c1nc(N2CCCC2)ncc1NC(=O)c1cccnc1
463422,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,20.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463423,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,20.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463424,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,45.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463425,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,60.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463426,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,20.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463427,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,45.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463428,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,20.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463429,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1,313.17713,[M+H]+,60.0,val,CC(C(=O)N1CC2CN(c3ncccn3)CC2C1)n1cccn1
463430,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463431,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463432,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,30.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463433,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,60.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463434,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463435,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,45.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463436,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463437,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,30.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463438,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1,313.17713,[M+H]+,60.0,val,O=C(c1cnccn1)N1CCCCC1c1nncn1CC1CC1
463439,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463440,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463441,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,45.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463442,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,60.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463443,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463444,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,45.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463445,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,20.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463446,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1,313.17713,[M+H]+,60.0,val,O=C(Nc1cnn(-c2ncncc2N2CCCCC2)c1)C1CC1
463447,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,313.17713,[M+H]+,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463448,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,313.17713,[M+H]+,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463449,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,313.17713,[M+H]+,60.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463450,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,313.17713,[M+H]+,15.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463451,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21,313.17713,[M+H]+,20.0,val,CC(C)n1ccc2c(NC(=O)CCCn3cnnn3)cccc21
463452,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,20.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463453,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,20.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463454,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,45.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463455,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,60.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463456,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,20.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463457,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,45.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463458,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,20.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463459,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1,313.17713,[M+H]+,60.0,val,CN(C(=O)c1ccnn1C)C1CN(c2cc3c(nn2)CCC3)C1
463460,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463461,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463462,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463463,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463464,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463465,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463466,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463467,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463468,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463469,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463470,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463471,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463472,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463473,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463474,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463475,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463476,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463477,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463478,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463479,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463480,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463481,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,45.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463482,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,60.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463483,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1,333.1589,[M+H]+,20.0,val,Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1
463484,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,20.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463485,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,20.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463486,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,30.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463487,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,60.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463488,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,20.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463489,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,45.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463490,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,60.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463491,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1,365.13097,[M+H]+,20.0,val,CSc1nc(C)cc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1
463492,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,20.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463493,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,20.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463494,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,60.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463495,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,30.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463496,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,20.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463497,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,60.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463498,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,30.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463499,O=C(Nc1c(F)ccc(F)c1)N1CCCC(N2CCCC2)C1,310.17255,[M+H]+,20.0,val,O=C(Nc1cc(F)ccc1F)N1CCCC(N2CCCC2)C1
463500,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,20.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463501,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,20.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463502,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,45.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463503,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,60.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463504,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,20.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463505,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,60.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463506,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,45.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463507,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1,310.17255,[M+H]+,20.0,val,CN(C(=O)C1CCC(F)(F)CC1)C1CN(c2ccccn2)C1
463508,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463509,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463510,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,60.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463511,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,30.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463512,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463513,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,60.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463514,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F,331.16279,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)NCc1ccccc1OC(F)(F)F
463515,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,329.14824,[M-H]-,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463516,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,329.14824,[M-H]-,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463517,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,329.14824,[M-H]-,60.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463518,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,329.14824,[M-H]-,30.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463519,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,329.14824,[M-H]-,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463520,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463521,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463522,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,60.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463523,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,30.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463524,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463525,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,30.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463526,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,20.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463527,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,331.16279,[M+H]+,60.0,val,CC(C)CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
463528,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,20.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463529,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,20.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463530,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,60.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463531,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,15.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463532,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,20.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463533,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,60.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463534,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,20.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463535,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1,331.16279,[M+H]+,15.0,val,Cc1cccnc1OCC1CCN(C(=O)CCC(F)(F)F)CC1
463536,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463537,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463538,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,30.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463539,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463540,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463541,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,45.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463542,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463543,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,30.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463544,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1,331.16279,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)cc1
463545,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,446.09338,[M+Cl]-,30.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463546,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,446.09338,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463547,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463548,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463549,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,60.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463550,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,30.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463551,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463552,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,60.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463553,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,30.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463554,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,456.12218,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463555,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463556,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463557,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463558,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,15.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463559,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463560,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463561,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,15.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463562,CCS(=O)(=O)N1CCC(NC(=O)NCc2c(C(F)(F)F)cc(F)cc2)CC1,412.13125,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(F)cc2C(F)(F)F)CC1
463563,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463564,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463565,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463566,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463567,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463568,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463569,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463570,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463571,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463572,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463573,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463574,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463575,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463576,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,45.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463577,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463578,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,347.16373,[M-H]-,60.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463579,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463580,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463581,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463582,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463583,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463584,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463585,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463586,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)Cn3cccn3)CC2)[nH]c(=O)c1F
463587,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463588,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463589,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463590,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463591,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463592,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,60.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463593,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,45.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463594,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F,349.17828,[M+H]+,20.0,val,CC(C)c1nc(N2CCN(C(=O)c3cn(C)cn3)CC2)[nH]c(=O)c1F
463595,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,20.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463596,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,20.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463597,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,60.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463598,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,30.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463599,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,20.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463600,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,60.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463601,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,30.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463602,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,366.09516,[M-H]-,20.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463603,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463604,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463605,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,60.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463606,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,30.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463607,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463608,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,60.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463609,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,30.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463610,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,366.09516,[M-H]-,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463611,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,368.10971,[M+H]+,30.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463612,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,368.10971,[M+H]+,30.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463613,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,368.10971,[M+H]+,20.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463614,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,368.10971,[M+H]+,60.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463615,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1,368.10971,[M+H]+,30.0,val,CCC(CC)c1nnc(NC(=O)CS(=O)(=O)Cc2ccccc2)s1
463616,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463617,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463618,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,60.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463619,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,30.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463620,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463621,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,60.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463622,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,30.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463623,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1,368.10971,[M+H]+,20.0,val,Cc1cc(C)c2sc(NC(=O)C3CCCCN3S(C)(=O)=O)nc2c1
463624,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463625,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463626,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,45.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463627,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,60.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463628,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463629,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,45.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463630,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,60.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463631,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,366.09516,[M-H]-,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463632,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463633,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463634,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,60.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463635,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,30.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463636,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463637,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,20.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463638,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,30.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463639,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO,368.10971,[M+H]+,60.0,val,O=C(CCCSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCO
463640,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,20.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463641,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,20.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463642,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,60.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463643,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,20.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463644,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,60.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463645,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1,368.10971,[M+H]+,20.0,val,COc1ccc2sc(N3CCCN(S(=O)(=O)C4CC4)CC3)nc2c1
463646,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463647,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463648,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,60.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463649,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,30.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463650,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463651,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,60.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463652,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,30.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463653,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,318.14593,[M-H]-,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463654,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463655,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463656,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,60.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463657,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,30.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463658,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463659,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,60.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463660,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,30.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463661,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,318.14593,[M-H]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463662,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,364.15141,[M+FA]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463663,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,364.15141,[M+FA]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463664,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,364.15141,[M+FA]-,60.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463665,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,364.15141,[M+FA]-,15.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463666,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,364.15141,[M+FA]-,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463667,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,302.14992,[M+H-H2O]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463668,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,302.14992,[M+H-H2O]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463669,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,302.14992,[M+H-H2O]+,60.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463670,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,302.14992,[M+H-H2O]+,30.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463671,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,302.14992,[M+H-H2O]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463672,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463673,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463674,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,60.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463675,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,30.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463676,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463677,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,60.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463678,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,30.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463679,COCc1c(C(=O)N[C@@H]2CC(Cn3cccn3)C[C@H]2O)occ1,320.16048,[M+H]+,20.0,val,COCc1ccoc1C(=O)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
463680,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463681,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463682,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,60.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463683,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,30.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463684,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463685,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,60.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463686,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,30.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463687,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1,320.16048,[M+H]+,20.0,val,COCc1ccc(C(=O)N[C@@H]2CC(Cn3ccnc3)C[C@H]2O)o1
463688,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,20.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463689,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,20.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463690,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,60.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463691,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,30.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463692,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,20.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463693,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,60.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463694,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,30.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463695,COC(=O)c1cc2c(nc1)N(C(=O)N1CCCC(O)C1)CCC2,320.16048,[M+H]+,20.0,val,COC(=O)c1cnc2c(c1)CCCN2C(=O)N1CCCC(O)C1
463696,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463697,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463698,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,60.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463699,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,30.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463700,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463701,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,60.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463702,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,30.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463703,COc1c(N2CCNC2=O)cc(C(=O)NC2(C)CCOC2)cc1,320.16048,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(C)CCOC2)cc1N1CCNC1=O
463704,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,320.16048,[M+H]+,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463705,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,320.16048,[M+H]+,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463706,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,320.16048,[M+H]+,60.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463707,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,320.16048,[M+H]+,15.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463708,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2c1cc(O)cc2)C(=O)O,320.16048,[M+H]+,20.0,val,CC(C)N(C)C(=O)N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(=O)O
463709,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463710,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463711,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,60.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463712,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,30.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463713,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463714,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,60.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463715,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,30.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463716,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463717,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463718,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463719,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,60.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463720,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463721,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,45.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463722,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,60.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463723,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463724,COc1c(OCC(O)Cn2nc(C)nc2C)ccc(C(C)=O)c1,320.16048,[M+H]+,45.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463725,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,364.15141,[M+FA]-,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463726,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,364.15141,[M+FA]-,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463727,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,364.15141,[M+FA]-,60.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463728,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,364.15141,[M+FA]-,15.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463729,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,364.15141,[M+FA]-,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463730,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463731,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463732,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463733,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,30.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463734,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463735,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463736,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,30.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463737,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,318.14593,[M-H]-,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463738,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463739,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463740,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463741,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,15.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463742,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463743,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,15.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463744,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463745,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,354.12261,[M+Cl]-,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463746,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,364.15141,[M+FA]-,60.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463747,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,364.15141,[M+FA]-,15.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463748,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,364.15141,[M+FA]-,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463749,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463750,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463751,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,60.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463752,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,30.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463753,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463754,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,60.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463755,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,30.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463756,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1,320.16048,[M+H]+,20.0,val,Nc1cc(C(=O)N2CCOCC2)cc(C(=O)N2CCOCC2)c1
463757,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,20.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463758,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,20.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463759,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,60.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463760,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,30.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463761,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,20.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463762,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,30.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463763,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,60.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463764,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1,320.16048,[M+H]+,20.0,val,Cc1ccn2c(=O)c(C(=O)NCCCOC(C)C)c(O)nc2c1
463765,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463766,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463767,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,30.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463768,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,60.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463769,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463770,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,45.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463771,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,20.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463772,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C,320.16048,[M+H]+,60.0,val,COc1cc(C(C)=O)ccc1OCC(O)Cn1nc(C)nc1C
463773,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463774,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463775,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,60.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463776,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,30.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463777,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463778,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,60.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463779,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,20.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463780,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC,320.16048,[M+H]+,30.0,val,COc1cc(C(=O)NCCCn2ccnc2)cc(OC)c1OC
463781,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463782,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463783,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463784,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,30.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463785,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463786,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,20.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463787,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,30.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463788,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1,320.16048,[M+H]+,60.0,val,CCC(CC)C(=O)Nc1nonc1-c1ccc(OC)c(OC)c1
463789,OC1CN(CCCOCCc2cc3c(cc2)scc3)C1,292.13658,[M+H]+,20.0,val,OC1CN(CCCOCCc2ccc3sccc3c2)C1
463790,OC1CN(CCCOCCc2cc3c(cc2)scc3)C1,292.13658,[M+H]+,20.0,val,OC1CN(CCCOCCc2ccc3sccc3c2)C1
463791,OC1CN(CCCOCCc2cc3c(cc2)scc3)C1,292.13658,[M+H]+,60.0,val,OC1CN(CCCOCCc2ccc3sccc3c2)C1
463792,OC1CN(CCCOCCc2cc3c(cc2)scc3)C1,292.13658,[M+H]+,20.0,val,OC1CN(CCCOCCc2ccc3sccc3c2)C1
463793,OC1CN(CCCOCCc2cc3c(cc2)scc3)C1,292.13658,[M+H]+,45.0,val,OC1CN(CCCOCCc2ccc3sccc3c2)C1
463794,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2,352.1019,[M+H]+,20.0,val,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2
463795,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2,352.1019,[M+H]+,20.0,val,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2
463796,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2,352.1019,[M+H]+,60.0,val,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2
463797,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2,352.1019,[M+H]+,30.0,val,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2
463798,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2,352.1019,[M+H]+,20.0,val,O=C(CCn1cc(Br)cn1)NC12CC3CC(CC(C3)C1)C2
463799,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463800,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463801,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,60.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463802,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463803,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,45.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463804,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,60.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463805,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463806,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,355.15872,[M-H]-,45.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463807,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,401.1642,[M+FA]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463808,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,401.1642,[M+FA]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463809,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,401.1642,[M+FA]-,60.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463810,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,401.1642,[M+FA]-,15.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463811,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,401.1642,[M+FA]-,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463812,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463813,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463814,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,30.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463815,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,60.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463816,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463817,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,45.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463818,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,60.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463819,O=C(Nc1nn(CC(=O)N2CCOCC2)cc1)C1CCC(F)(F)CC1,357.17327,[M+H]+,20.0,val,O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C1CCC(F)(F)CC1
463820,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,20.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463821,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,20.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463822,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,60.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463823,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,30.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463824,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,20.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463825,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,60.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463826,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,30.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463827,CC1CN(C(=O)c2c(C(F)(F)F)cncc2)CCN1CC(C)(C)O,346.17369,[M+H]+,20.0,val,CC1CN(C(=O)c2ccncc2C(F)(F)F)CCN1CC(C)(C)O
463828,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,20.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463829,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,20.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463830,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,60.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463831,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,30.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463832,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,20.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463833,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,60.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463834,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,30.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463835,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1,264.17582,[M+H]+,20.0,val,CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
463836,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,273.16085,[M-H]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463837,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,273.16085,[M-H]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463838,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,273.16085,[M-H]-,60.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463839,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,273.16085,[M-H]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463840,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,273.16085,[M-H]-,45.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463841,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,309.13753,[M+Cl]-,15.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463842,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,309.13753,[M+Cl]-,15.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463843,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,309.13753,[M+Cl]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463844,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,309.13753,[M+Cl]-,15.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463845,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,319.16633,[M+FA]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463846,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,319.16633,[M+FA]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463847,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,319.16633,[M+FA]-,60.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463848,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,319.16633,[M+FA]-,15.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463849,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,319.16633,[M+FA]-,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463850,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,273.16085,[M-H]-,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463851,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,273.16085,[M-H]-,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463852,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,273.16085,[M-H]-,60.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463853,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,273.16085,[M-H]-,30.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463854,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,273.16085,[M-H]-,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463855,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,319.16633,[M+FA]-,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463856,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,319.16633,[M+FA]-,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463857,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,319.16633,[M+FA]-,60.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463858,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,319.16633,[M+FA]-,15.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463859,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,319.16633,[M+FA]-,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463860,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,275.1754,[M+H]+,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463861,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,275.1754,[M+H]+,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463862,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,275.1754,[M+H]+,60.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463863,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,275.1754,[M+H]+,15.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463864,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1,275.1754,[M+H]+,20.0,val,Cc1ccccc1CC(C)(C)NC(=O)C1CCC(=O)N1
463865,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,275.1754,[M+H]+,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463866,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,275.1754,[M+H]+,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463867,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,275.1754,[M+H]+,60.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463868,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,275.1754,[M+H]+,30.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463869,Cc1c(CCNC(=O)C2CCNC(=O)C2)c(C)ccc1,275.1754,[M+H]+,20.0,val,Cc1cccc(C)c1CCNC(=O)C1CCNC(=O)C1
463870,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,275.1754,[M+H]+,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463871,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,275.1754,[M+H]+,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463872,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,275.1754,[M+H]+,60.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463873,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,275.1754,[M+H]+,30.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463874,CCc1c(C)ccc(NC(=O)C2(C)CCC(=O)NC2)c1,275.1754,[M+H]+,20.0,val,CCc1cc(NC(=O)C2(C)CCC(=O)NC2)ccc1C
463875,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1,275.1754,[M+H]+,20.0,val,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1
463876,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1,275.1754,[M+H]+,20.0,val,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1
463877,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1,275.1754,[M+H]+,60.0,val,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1
463878,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1,275.1754,[M+H]+,15.0,val,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1
463879,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1,275.1754,[M+H]+,20.0,val,O=C(NCC1CCOCC1)NC1(c2ccccc2)CC1
463880,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1,275.1754,[M+H]+,20.0,val,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1
463881,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1,275.1754,[M+H]+,20.0,val,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1
463882,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1,275.1754,[M+H]+,60.0,val,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1
463883,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1,275.1754,[M+H]+,15.0,val,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1
463884,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1,275.1754,[M+H]+,20.0,val,COC1(CC(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CCC1
463885,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,20.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463886,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,20.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463887,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,60.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463888,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,30.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463889,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,20.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463890,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,60.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463891,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,30.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463892,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1,275.1754,[M+H]+,20.0,val,N[C@@H]1CN(C(=O)C2CCOCC2)C[C@H]1c1ccccc1
463893,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc2c(cc1)ccn2C,275.1754,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1ccc2ccn(C)c2c1
463894,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc2c(cc1)ccn2C,275.1754,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1ccc2ccn(C)c2c1
463895,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc2c(cc1)ccn2C,275.1754,[M+H]+,60.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1ccc2ccn(C)c2c1
463896,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc2c(cc1)ccn2C,275.1754,[M+H]+,15.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1ccc2ccn(C)c2c1
463897,CC[C@@H](C)[C@@H](CO)NC(=O)c1cc2c(cc1)ccn2C,275.1754,[M+H]+,20.0,val,CC[C@@H](C)[C@@H](CO)NC(=O)c1ccc2ccn(C)c2c1
463898,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,20.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463899,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,20.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463900,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,30.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463901,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,60.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463902,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,15.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463903,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,20.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463904,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,20.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463905,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N,275.1754,[M+H]+,60.0,val,COc1cc(OC2C(C)(C)C(N)C2(C)C)ccc1C#N
463906,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,20.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463907,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,20.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463908,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,60.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463909,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,30.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463910,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,20.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463911,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,30.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463912,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,20.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463913,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2,275.1754,[M+H]+,60.0,val,NC12CCCC(NC(=O)OCc3ccccc3)(CC1)C2
463914,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463915,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463916,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,60.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463917,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463918,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,45.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463919,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,60.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463920,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,337.12275,[M-H]-,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463921,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463922,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463923,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,60.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463924,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,30.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463925,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463926,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,60.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463927,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,30.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463928,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,337.12275,[M-H]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463929,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,373.09943,[M+Cl]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463930,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,373.09943,[M+Cl]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463931,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,373.09943,[M+Cl]-,60.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463932,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,373.09943,[M+Cl]-,15.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463933,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,373.09943,[M+Cl]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463934,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,383.12823,[M+FA]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463935,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,383.12823,[M+FA]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463936,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,383.12823,[M+FA]-,60.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463937,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,383.12823,[M+FA]-,15.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463938,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,383.12823,[M+FA]-,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463939,O=C1CCCc2c(ccc(S(=O)(=O)NC3CCC(O)CC3)c2)N1,337.12275,[M-H]-,20.0,val,O=C1CCCc2cc(S(=O)(=O)NC3CCC(O)CC3)ccc2N1
463940,O=C1CCCc2c(ccc(S(=O)(=O)NC3CCC(O)CC3)c2)N1,337.12275,[M-H]-,20.0,val,O=C1CCCc2cc(S(=O)(=O)NC3CCC(O)CC3)ccc2N1
463941,O=C1CCCc2c(ccc(S(=O)(=O)NC3CCC(O)CC3)c2)N1,337.12275,[M-H]-,60.0,val,O=C1CCCc2cc(S(=O)(=O)NC3CCC(O)CC3)ccc2N1
463942,O=C1CCCc2c(ccc(S(=O)(=O)NC3CCC(O)CC3)c2)N1,337.12275,[M-H]-,20.0,val,O=C1CCCc2cc(S(=O)(=O)NC3CCC(O)CC3)ccc2N1
463943,O=C1CCCc2c(ccc(S(=O)(=O)NC3CCC(O)CC3)c2)N1,337.12275,[M-H]-,60.0,val,O=C1CCCc2cc(S(=O)(=O)NC3CCC(O)CC3)ccc2N1
463944,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,339.1373,[M+H]+,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463945,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,339.1373,[M+H]+,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463946,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,339.1373,[M+H]+,60.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463947,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,339.1373,[M+H]+,15.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463948,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1,339.1373,[M+H]+,20.0,val,O=C(O)C1CCCN(S(=O)(=O)N(Cc2ccccc2)C2CC2)C1
463949,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,20.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463950,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,20.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463951,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,60.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463952,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,30.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463953,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,20.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463954,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,60.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463955,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,30.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463956,C=C1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)c(OC)cc2)CC1,339.1373,[M+H]+,20.0,val,C=C1CCN(C(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)CC1
463957,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C,339.1373,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C
463958,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C,339.1373,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C
463959,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C,339.1373,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C
463960,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C,339.1373,[M+H]+,15.0,val,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C
463961,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C,339.1373,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCN(C(=O)C3CC3)C2)cc1C
463962,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,339.1373,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463963,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,339.1373,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463964,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,339.1373,[M+H]+,60.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463965,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,339.1373,[M+H]+,15.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463966,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2cc(C)c(C)cc2)C1,339.1373,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1
463967,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2,337.12275,[M-H]-,20.0,val,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2
463968,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2,337.12275,[M-H]-,20.0,val,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2
463969,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2,337.12275,[M-H]-,60.0,val,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2
463970,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2,337.12275,[M-H]-,20.0,val,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2
463971,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2,337.12275,[M-H]-,45.0,val,COCCCNS(=O)(=O)c1cc2c3c(c1)C(C)C(=O)N3CCC2
463972,COc1c(CN2CCOCC2)cc(C2NC(C(=O)O)CS2)cc1,339.1373,[M+H]+,20.0,val,COc1ccc(C2NC(C(=O)O)CS2)cc1CN1CCOCC1
463973,COc1c(CN2CCOCC2)cc(C2NC(C(=O)O)CS2)cc1,339.1373,[M+H]+,20.0,val,COc1ccc(C2NC(C(=O)O)CS2)cc1CN1CCOCC1
463974,COc1c(CN2CCOCC2)cc(C2NC(C(=O)O)CS2)cc1,339.1373,[M+H]+,60.0,val,COc1ccc(C2NC(C(=O)O)CS2)cc1CN1CCOCC1
463975,COc1c(CN2CCOCC2)cc(C2NC(C(=O)O)CS2)cc1,339.1373,[M+H]+,30.0,val,COc1ccc(C2NC(C(=O)O)CS2)cc1CN1CCOCC1
463976,COc1c(CN2CCOCC2)cc(C2NC(C(=O)O)CS2)cc1,339.1373,[M+H]+,20.0,val,COc1ccc(C2NC(C(=O)O)CS2)cc1CN1CCOCC1
463977,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,337.12275,[M-H]-,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463978,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,337.12275,[M-H]-,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463979,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,337.12275,[M-H]-,60.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463980,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,337.12275,[M-H]-,30.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463981,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,337.12275,[M-H]-,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463982,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463983,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463984,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,30.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463985,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,60.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463986,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,15.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463987,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463988,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,60.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463989,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O,339.1373,[M+H]+,20.0,val,CSCCC(NC(=O)CCNC(=O)c1ccc(C)cc1)C(=O)O
463990,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463991,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463992,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,15.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463993,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,60.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463994,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,30.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463995,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463996,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463997,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,337.12275,[M-H]-,60.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463998,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,373.09943,[M+Cl]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
463999,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,373.09943,[M+Cl]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464000,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,373.09943,[M+Cl]-,15.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464001,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464002,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464003,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,60.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464004,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,15.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464005,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464006,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464007,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,15.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464008,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,383.12823,[M+FA]-,60.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464009,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1,337.12275,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1
464010,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1,337.12275,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1
464011,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1,337.12275,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1
464012,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1,337.12275,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1
464013,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1,337.12275,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NCCC(O)c2cccn2C)c(C)c1
464014,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,337.12275,[M-H]-,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464015,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,337.12275,[M-H]-,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464016,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,337.12275,[M-H]-,45.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464017,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,337.12275,[M-H]-,60.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464018,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,337.12275,[M-H]-,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464019,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,337.12275,[M-H]-,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464020,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,337.12275,[M-H]-,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464021,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,337.12275,[M-H]-,45.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464022,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,337.12275,[M-H]-,60.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464023,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,337.12275,[M-H]-,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464024,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C,337.12275,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C
464025,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C,337.12275,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C
464026,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C,337.12275,[M-H]-,45.0,val,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C
464027,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C,337.12275,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C
464028,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C,337.12275,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)NCC(O)c2cccn2C)cc1C
464029,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,337.12275,[M-H]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464030,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,337.12275,[M-H]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464031,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,337.12275,[M-H]-,60.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464032,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,337.12275,[M-H]-,15.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464033,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,337.12275,[M-H]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464034,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464035,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464036,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,60.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464037,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,15.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464038,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464039,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464040,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,15.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464041,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,383.12823,[M+FA]-,60.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464042,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,321.12674,[M+H-H2O]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464043,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,321.12674,[M+H-H2O]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464044,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,321.12674,[M+H-H2O]+,60.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464045,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,321.12674,[M+H-H2O]+,30.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464046,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,321.12674,[M+H-H2O]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464047,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,339.1373,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464048,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,339.1373,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464049,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,339.1373,[M+H]+,60.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464050,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,339.1373,[M+H]+,30.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464051,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1,339.1373,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1cccc(C(=O)N2CCNC(=O)C2(C)C)c1
464052,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464053,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464054,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,30.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464055,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,60.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464056,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,15.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464057,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464058,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,20.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464059,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,339.1373,[M+H]+,60.0,val,CC(=O)NCC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
464060,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,339.1373,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464061,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,339.1373,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464062,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,339.1373,[M+H]+,60.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464063,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,339.1373,[M+H]+,15.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464064,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1,339.1373,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CN(C(=O)CNC(=O)c2ccccc2)C1
464065,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,20.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464066,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,20.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464067,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,60.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464068,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,30.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464069,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,20.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464070,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,60.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464071,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,20.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464072,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC,339.1373,[M+H]+,30.0,val,CCOc1cc(C(=O)NC2=NCCS2)cc(OCC)c1OCC
464073,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464074,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464075,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,60.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464076,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,30.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464077,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464078,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,30.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464079,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,20.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464080,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O,339.1373,[M+H]+,60.0,val,CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O
464081,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464082,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464083,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,60.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464084,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,30.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464085,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464086,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464087,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,30.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464088,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,339.1373,[M+H]+,60.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464089,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,361.11925,[M+Na]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464090,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,361.11925,[M+Na]+,45.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464091,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1,361.11925,[M+Na]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1
464092,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21,339.1373,[M+H]+,20.0,val,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21
464093,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21,339.1373,[M+H]+,20.0,val,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21
464094,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21,339.1373,[M+H]+,60.0,val,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21
464095,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21,339.1373,[M+H]+,30.0,val,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21
464096,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21,339.1373,[M+H]+,20.0,val,CC(C)C(=O)N1CCc2cc(S(=O)(=O)N3CCOCC3)ccc21
464097,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464098,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464099,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,60.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464100,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,15.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464101,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464102,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,20.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464103,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,15.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464104,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC,339.1373,[M+H]+,60.0,val,COc1cc(C(=O)NC(=S)N2CCCCC2)cc(OC)c1OC
464105,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1,339.1373,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1
464106,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1,339.1373,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1
464107,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1,339.1373,[M+H]+,60.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1
464108,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1,339.1373,[M+H]+,15.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1
464109,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1,339.1373,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=S)N1CCCCC1
464110,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464111,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464112,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,60.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464113,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,15.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464114,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464115,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,60.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464116,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,15.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464117,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,369.11258,[M-H]-,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464118,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464119,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464120,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,60.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464121,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,30.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464122,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464123,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,60.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464124,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,30.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464125,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,369.11258,[M-H]-,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464126,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,335.10601,[M+H-2H2O]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464127,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,335.10601,[M+H-2H2O]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464128,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,335.10601,[M+H-2H2O]+,60.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464129,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,335.10601,[M+H-2H2O]+,15.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464130,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,335.10601,[M+H-2H2O]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464131,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464132,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464133,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,60.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464134,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,30.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464135,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464136,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,60.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464137,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,30.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464138,Cc1c(S(=O)(=O)N2CCCC2)cc(C(=O)N2CCC[C@H](C(=O)O)C2)o1,371.12713,[M+H]+,20.0,val,Cc1oc(C(=O)N2CCC[C@H](C(=O)O)C2)cc1S(=O)(=O)N1CCCC1
464139,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,371.12713,[M+H]+,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464140,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,371.12713,[M+H]+,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464141,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,371.12713,[M+H]+,60.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464142,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,371.12713,[M+H]+,15.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464143,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cc(NS(C)(=O)=O)ccc1,371.12713,[M+H]+,20.0,val,CC(NC(=O)C1(C(=O)O)CCOCC1)c1cccc(NS(C)(=O)=O)c1
464144,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464145,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464146,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,361.16298,[M-H]-,60.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464147,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,361.16298,[M-H]-,30.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464148,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464149,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464150,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464151,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,363.17753,[M+H]+,60.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464152,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,363.17753,[M+H]+,30.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464153,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
464154,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464155,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464156,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464157,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,30.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464158,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464159,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464160,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,30.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464161,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,361.16298,[M-H]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464162,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,397.13965,[M+Cl]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464163,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,397.13965,[M+Cl]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464164,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,397.13965,[M+Cl]-,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464165,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,397.13965,[M+Cl]-,15.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464166,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,397.13965,[M+Cl]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464167,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,407.16846,[M+FA]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464168,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,407.16846,[M+FA]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464169,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,407.16846,[M+FA]-,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464170,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,407.16846,[M+FA]-,15.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464171,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,407.16846,[M+FA]-,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464172,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464173,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464174,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464175,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,30.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464176,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464177,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,60.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464178,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,30.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464179,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,363.17753,[M+H]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464180,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,385.15947,[M+Na]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464181,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,385.15947,[M+Na]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464182,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1,385.15947,[M+Na]+,20.0,val,NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1
464183,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,341.1096,[M-H]-,30.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464184,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,341.1096,[M-H]-,30.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464185,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,341.1096,[M-H]-,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464186,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,341.1096,[M-H]-,60.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464187,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,341.1096,[M-H]-,30.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464188,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,377.08628,[M+Cl]-,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464189,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,377.08628,[M+Cl]-,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464190,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,377.08628,[M+Cl]-,60.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464191,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,377.08628,[M+Cl]-,15.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464192,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,377.08628,[M+Cl]-,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464193,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464194,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464195,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,60.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464196,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,30.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464197,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464198,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,30.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464199,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,20.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464200,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl,343.12415,[M+H]+,60.0,val,COc1cc(NC(=S)NC2CCCCCC2)c(OC)cc1Cl
464201,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,341.13407,[M-H]-,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464202,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,341.13407,[M-H]-,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464203,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,341.13407,[M-H]-,60.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464204,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,341.13407,[M-H]-,60.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464205,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464206,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464207,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,60.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464208,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,30.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464209,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464210,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,45.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464211,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,20.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464212,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1,343.14862,[M+H]+,60.0,val,Cc1cc(F)ccc1S(=O)(=O)NC1CCN(C2CCOCC2)C1
464213,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464214,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464215,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,60.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464216,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,15.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464217,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464218,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,20.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464219,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,15.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464220,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1,318.17469,[M+H]+,60.0,val,c1ccc(-n2nnnc2SCCNCC2CCCCC2)cc1
464221,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,354.13807,[M+FA]-,15.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464222,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,354.13807,[M+FA]-,15.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464223,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,20.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464224,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,20.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464225,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,60.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464226,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,30.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464227,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,20.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464228,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,60.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464229,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,30.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464230,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1,310.14714,[M+H]+,20.0,val,O=S(=O)(CCO)c1ccc(CNC2CCC23CCC3)cc1
464231,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,310.14714,[M+H]+,20.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464232,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,310.14714,[M+H]+,20.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464233,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,310.14714,[M+H]+,60.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464234,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,310.14714,[M+H]+,30.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464235,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1,310.14714,[M+H]+,20.0,val,CC(C)(C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1
464236,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,20.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464237,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,20.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464238,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,60.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464239,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,30.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464240,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,20.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464241,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,60.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464242,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,30.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464243,CCc1cc(CC(=O)N2CCC(CS(C)(=O)=O)C2)ccc1,310.14714,[M+H]+,20.0,val,CCc1cccc(CC(=O)N2CCC(CS(C)(=O)=O)C2)c1
464244,Cc1cc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)ccc1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464245,Cc1cc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)ccc1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464246,Cc1cc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)ccc1,310.14714,[M+H]+,60.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464247,Cc1cc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)ccc1,310.14714,[M+H]+,30.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464248,Cc1cc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)ccc1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464249,O=C(CSC1CCCC1)NCC1(O)CCCc2c1cco2,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464250,O=C(CSC1CCCC1)NCC1(O)CCCc2c1cco2,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464251,O=C(CSC1CCCC1)NCC1(O)CCCc2c1cco2,292.13658,[M+H-H2O]+,60.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464252,O=C(CSC1CCCC1)NCC1(O)CCCc2c1cco2,292.13658,[M+H-H2O]+,30.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464253,O=C(CSC1CCCC1)NCC1(O)CCCc2c1cco2,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464254,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464255,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464256,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,60.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464257,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,30.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464258,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464259,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,344.10927,[M+Cl]-,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464260,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,344.10927,[M+Cl]-,15.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464261,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,344.10927,[M+Cl]-,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464262,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,308.13259,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464263,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,308.13259,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464264,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,308.13259,[M-H]-,60.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464265,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,308.13259,[M-H]-,30.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464266,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,308.13259,[M-H]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464267,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,354.13807,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464268,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,354.13807,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464269,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,354.13807,[M+FA]-,60.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464270,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,354.13807,[M+FA]-,15.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464271,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,354.13807,[M+FA]-,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464272,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464273,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464274,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,60.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464275,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,30.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464276,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464277,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464278,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,30.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464279,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1,310.14714,[M+H]+,60.0,val,CN(CC1COCCO1)C(=O)C1(c2cccs2)CCCC1
464280,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,20.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464281,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,20.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464282,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,60.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464283,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,30.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464284,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,20.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464285,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,60.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464286,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,30.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464287,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC,310.14714,[M+H]+,20.0,val,CCCCOc1ccc(C(=S)N2CCOCC2)cc1OC
464288,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464289,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464290,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,60.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464291,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,30.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464292,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464293,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,30.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464294,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,20.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464295,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1,310.14714,[M+H]+,60.0,val,Cc1cccc(CC(=O)N2CC(S(=O)(=O)CC(C)C)C2)c1
464296,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464297,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464298,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,292.13658,[M+H-H2O]+,60.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464299,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,292.13658,[M+H-H2O]+,30.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464300,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21,292.13658,[M+H-H2O]+,20.0,val,O=C(CSC1CCCC1)NCC1(O)CCCc2occc21
464301,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464302,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464303,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,60.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464304,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,30.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464305,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1,310.14714,[M+H]+,20.0,val,CCC(C(=O)N1CCC(S(C)(=O)=O)CC1)c1ccccc1
464306,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,292.13658,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464307,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,292.13658,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464308,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,292.13658,[M+H-H2O]+,60.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464309,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,292.13658,[M+H-H2O]+,30.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464310,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,292.13658,[M+H-H2O]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464311,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464312,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464313,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,310.14714,[M+H]+,60.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464314,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,310.14714,[M+H]+,15.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464315,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1,310.14714,[M+H]+,20.0,val,O=C(NCC1(O)CCOCC1)C1(c2cccs2)CCCC1
464316,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,20.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464317,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,20.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464318,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,60.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464319,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,20.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464320,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,45.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464321,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,60.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464322,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,20.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464323,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23,342.15473,[M+H]+,45.0,val,CC1C(=O)OCC2=CC[N+]3([O-])CCC(OC(=O)C(C)(O)C1(C)O)C23
464324,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464325,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464326,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,60.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464327,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,15.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464328,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464329,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,60.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464330,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,15.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464331,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,372.11541,[M-H]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464332,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,408.09209,[M+Cl]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464333,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,408.09209,[M+Cl]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464334,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,408.09209,[M+Cl]-,60.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464335,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,408.09209,[M+Cl]-,15.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464336,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,408.09209,[M+Cl]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464337,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,418.12089,[M+FA]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464338,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,418.12089,[M+FA]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464339,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,418.12089,[M+FA]-,60.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464340,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,418.12089,[M+FA]-,15.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464341,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,418.12089,[M+FA]-,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464342,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,374.12997,[M+H]+,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464343,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,374.12997,[M+H]+,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464344,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,374.12997,[M+H]+,60.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464345,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,374.12997,[M+H]+,15.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464346,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1,374.12997,[M+H]+,20.0,val,CS(=O)(=O)NCC1CCCCN1C(=O)NCCc1ccc(Cl)cc1
464347,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464348,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464349,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,60.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464350,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,30.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464351,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464352,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,60.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464353,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,30.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464354,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1,343.19401,[M+H]+,20.0,val,Cc1c(C(=O)N2CCC(F)(F)C(CO)C2)nnn1CC1CCCC1
464355,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,20.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464356,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,20.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464357,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,30.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464358,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,60.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464359,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,15.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464360,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,20.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464361,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,60.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464362,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1,343.19401,[M+H]+,20.0,val,CCn1nccc1[C@@H]1OCC[C@H]1C(=O)N1CCN(CC(F)F)CC1
464363,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464364,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464365,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,60.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464366,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,30.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464367,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464368,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,60.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464369,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,30.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464370,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(c1ccccc1O)N1CCC(CN2CCCC2)CC1
464371,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,369.14897,[M+FA]-,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464372,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,369.14897,[M+FA]-,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464373,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,369.14897,[M+FA]-,60.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464374,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,369.14897,[M+FA]-,15.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464375,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,369.14897,[M+FA]-,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464376,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464377,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464378,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464379,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,30.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464380,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464381,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,30.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464382,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464383,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,323.14349,[M-H]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464384,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,359.12016,[M+Cl]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464385,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464386,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464387,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464388,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,15.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464389,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464390,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464391,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,15.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464392,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,369.14897,[M+FA]-,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464393,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,369.14897,[M+FA]-,20.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464394,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,369.14897,[M+FA]-,20.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464395,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,369.14897,[M+FA]-,60.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464396,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,369.14897,[M+FA]-,15.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464397,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,369.14897,[M+FA]-,20.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464398,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464399,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464400,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,60.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464401,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,15.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464402,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464403,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,15.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464404,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464405,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,369.14897,[M+FA]-,60.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464406,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,323.14349,[M-H]-,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464407,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,323.14349,[M-H]-,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464408,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,323.14349,[M-H]-,60.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464409,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,323.14349,[M-H]-,15.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464410,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,323.14349,[M-H]-,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464411,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,369.14897,[M+FA]-,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464412,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,369.14897,[M+FA]-,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464413,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,369.14897,[M+FA]-,60.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464414,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,369.14897,[M+FA]-,15.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464415,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,369.14897,[M+FA]-,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464416,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464417,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464418,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,60.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464419,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,30.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464420,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464421,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,30.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464422,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464423,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O,325.15804,[M+H]+,60.0,val,CN(CC(=O)N1CCCCC(c2ccccc2)C1)S(C)(=O)=O
464424,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,307.14748,[M+H-H2O]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464425,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,307.14748,[M+H-H2O]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464426,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,307.14748,[M+H-H2O]+,60.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464427,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,307.14748,[M+H-H2O]+,30.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464428,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,307.14748,[M+H-H2O]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464429,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464430,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464431,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,60.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464432,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,30.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464433,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464434,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,60.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464435,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,30.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464436,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1,325.15804,[M+H]+,20.0,val,O=S(=O)(Cc1ccccc1)N1CCN(CC(O)C2CC2)CC1
464437,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464438,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464439,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,60.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464440,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,30.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464441,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464442,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,45.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464443,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,60.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464444,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(CN2CCCC(NS(=O)(=O)C3CC3)C2)c1
464445,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464446,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464447,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,45.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464448,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,60.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464449,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464450,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464451,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,45.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464452,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1,325.15804,[M+H]+,60.0,val,O=S(=O)(CCc1ccccc1)NC1CN(C2CCOCC2)C1
464453,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,325.15804,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464454,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,325.15804,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464455,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,325.15804,[M+H]+,60.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464456,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,325.15804,[M+H]+,15.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464457,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C,325.15804,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)c1C
464458,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,325.15804,[M+H]+,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464459,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,325.15804,[M+H]+,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464460,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,325.15804,[M+H]+,60.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464461,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,325.15804,[M+H]+,15.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464462,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1,325.15804,[M+H]+,20.0,val,COC1(CNC(=O)NCCOc2ccccc2)CCSCC1
464463,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464464,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464465,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,60.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464466,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,15.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464467,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464468,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,45.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464469,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,60.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464470,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O,325.15804,[M+H]+,20.0,val,CN(c1ccc(C(=O)NC2CCCCCC2)cc1)S(C)(=O)=O
464471,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,325.15804,[M+H]+,15.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464472,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,325.15804,[M+H]+,15.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464473,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,325.15804,[M+H]+,60.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464474,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,325.15804,[M+H]+,20.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464475,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C,325.15804,[M+H]+,15.0,val,CCOC(=O)c1c(NC(=O)NC2CCCCC2)sc(C)c1C
464476,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1
464477,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1
464478,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1,325.15804,[M+H]+,60.0,val,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1
464479,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1,325.15804,[M+H]+,15.0,val,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1
464480,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1,325.15804,[M+H]+,20.0,val,COc1cccc(N2CCN(CC3CCS(=O)(=O)C3)CC2)c1
464481,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464482,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464483,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464484,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,30.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464485,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464486,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,30.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464487,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,20.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464488,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1,325.15804,[M+H]+,60.0,val,CC(C)(C)c1ccc(NC(=O)N2CCC(S(C)(=O)=O)C2)cc1
464489,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464490,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464491,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464492,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464493,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,45.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464494,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464495,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464496,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,339.1384,[M-H]-,45.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464497,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,375.11508,[M+Cl]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464498,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,375.11508,[M+Cl]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464499,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,375.11508,[M+Cl]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464500,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,375.11508,[M+Cl]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464501,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464502,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464503,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,385.14388,[M+FA]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464504,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,385.14388,[M+FA]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464505,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464506,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464507,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464508,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464509,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464510,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464511,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464512,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464513,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,339.1384,[M-H]-,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464514,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,339.1384,[M-H]-,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464515,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,339.1384,[M-H]-,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464516,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,339.1384,[M-H]-,60.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464517,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,339.1384,[M-H]-,30.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464518,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,339.1384,[M-H]-,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464519,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,341.15295,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464520,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,341.15295,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464521,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,341.15295,[M+H]+,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464522,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,341.15295,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464523,CCN1C(=O)CCc2c1ccc(NS(=O)(=O)CCOC(C)C)c2,341.15295,[M+H]+,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)CCOC(C)C)ccc21
464524,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,341.15295,[M+H]+,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464525,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,341.15295,[M+H]+,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464526,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,341.15295,[M+H]+,60.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464527,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,341.15295,[M+H]+,15.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464528,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1,341.15295,[M+H]+,20.0,val,CN(C1CCCCC1)S(=O)(=O)Nc1cccc(CCC(=O)O)c1
464529,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,341.15295,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464530,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,341.15295,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464531,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,341.15295,[M+H]+,60.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464532,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,341.15295,[M+H]+,30.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464533,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1,341.15295,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCC(C)C(O)C2)cc1
464534,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464535,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464536,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,60.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464537,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,30.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464538,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464539,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,60.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464540,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,30.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464541,CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(CC)c1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464542,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,339.1384,[M-H]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464543,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,339.1384,[M-H]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464544,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,339.1384,[M-H]-,60.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464545,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,339.1384,[M-H]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464546,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,339.1384,[M-H]-,60.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464547,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,385.14388,[M+FA]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464548,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,385.14388,[M+FA]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464549,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,385.14388,[M+FA]-,60.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464550,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,385.14388,[M+FA]-,15.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464551,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,385.14388,[M+FA]-,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464552,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464553,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464554,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464555,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464556,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464557,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,339.1384,[M-H]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464558,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.11508,[M+Cl]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464559,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.11508,[M+Cl]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464560,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.11508,[M+Cl]-,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464561,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.11508,[M+Cl]-,15.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464562,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464563,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464564,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,385.14388,[M+FA]-,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464565,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,385.14388,[M+FA]-,15.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464566,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,385.14388,[M+FA]-,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464567,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,375.11508,[M+Cl]-,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464568,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,375.11508,[M+Cl]-,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464569,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,375.11508,[M+Cl]-,60.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464570,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,375.11508,[M+Cl]-,15.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464571,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,375.11508,[M+Cl]-,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464572,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,20.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464573,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,20.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464574,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,30.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464575,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,60.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464576,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,15.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464577,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,20.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464578,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,60.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464579,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C,341.15295,[M+H]+,20.0,val,Cc1ccc(N(CC(=O)NCC2CCCO2)S(C)(=O)=O)cc1C
464580,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464581,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464582,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464583,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,30.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464584,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464585,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464586,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,30.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464587,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,341.15295,[M+H]+,60.0,val,CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
464588,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464589,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464590,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,60.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464591,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,30.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464592,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464593,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,30.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464594,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,60.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464595,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1,341.15295,[M+H]+,20.0,val,CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1
464596,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,341.15295,[M+H]+,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464597,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,341.15295,[M+H]+,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464598,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,341.15295,[M+H]+,60.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464599,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,341.15295,[M+H]+,30.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464600,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1,341.15295,[M+H]+,20.0,val,CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCOCC2)cc1
464601,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,287.18774,[M-H]-,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464602,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,287.18774,[M-H]-,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464603,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,287.18774,[M-H]-,60.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464604,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,287.18774,[M-H]-,45.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464605,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,20.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464606,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,20.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464607,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,60.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464608,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,30.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464609,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,20.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464610,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,60.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464611,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,30.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464612,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2,289.20229,[M+H]+,20.0,val,Cn1ncc(C2CC2)c1CNC(=O)C1NCC12CCCC2
464613,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,20.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464614,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,20.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464615,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,60.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464616,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,20.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464617,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,60.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464618,CC(C)(C)c1nn2ccnc(N3CCC(CO)CC3)c2c1,289.20229,[M+H]+,20.0,val,CC(C)(C)c1cc2c(N3CCC(CO)CC3)nccn2n1
464619,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464620,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464621,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,60.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464622,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,30.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464623,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464624,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,60.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464625,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,30.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464626,COCCN1CCC(NCc2cc3c(cc2)nc[nH]3)CC1,289.20229,[M+H]+,20.0,val,COCCN1CCC(NCc2ccc3nc[nH]c3c2)CC1
464627,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc12,289.20229,[M+H]+,30.0,val,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc21
464628,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc12,289.20229,[M+H]+,30.0,val,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc21
464629,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc12,289.20229,[M+H]+,20.0,val,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc21
464630,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc12,289.20229,[M+H]+,60.0,val,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc21
464631,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc12,289.20229,[M+H]+,30.0,val,O=C(N[C@@H]1C[C@H]1C1CCCCC1)C1CCCn2ncnc21
464632,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,20.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464633,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,20.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464634,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,60.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464635,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,20.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464636,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,45.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464637,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,60.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464638,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1,289.20229,[M+H]+,20.0,val,CCC1(C)CCN(C(=O)c2cnc(C3CC3)nc2N)CC1
464639,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,20.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464640,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,20.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464641,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,60.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464642,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,30.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464643,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,20.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464644,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,60.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464645,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,30.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464646,O=C(CCc1nccnc1)NC1CCN(CC2CC2)CC1,289.20229,[M+H]+,20.0,val,O=C(CCc1cnccn1)NC1CCN(CC2CC2)CC1
464647,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464648,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464649,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,60.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464650,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,30.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464651,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464652,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,45.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464653,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,60.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464654,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,319.17757,[M-H]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464655,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,365.18304,[M+FA]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464656,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,365.18304,[M+FA]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464657,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,365.18304,[M+FA]-,60.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464658,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,365.18304,[M+FA]-,15.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464659,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,365.18304,[M+FA]-,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464660,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,319.17757,[M-H]-,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464661,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,319.17757,[M-H]-,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464662,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,319.17757,[M-H]-,60.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464663,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,319.17757,[M-H]-,30.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464664,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,319.17757,[M-H]-,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464665,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,365.18304,[M+FA]-,15.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464666,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,365.18304,[M+FA]-,15.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464667,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,365.18304,[M+FA]-,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464668,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,365.18304,[M+FA]-,60.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464669,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,365.18304,[M+FA]-,15.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464670,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464671,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464672,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,60.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464673,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,30.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464674,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464675,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,60.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464676,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,30.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464677,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,319.17757,[M-H]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464678,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,365.18304,[M+FA]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464679,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,365.18304,[M+FA]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464680,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,365.18304,[M+FA]-,60.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464681,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,365.18304,[M+FA]-,15.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464682,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,365.18304,[M+FA]-,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464683,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,20.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464684,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,20.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464685,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,60.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464686,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,30.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464687,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,20.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464688,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,60.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464689,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,30.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464690,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1,321.19212,[M+H]+,20.0,val,COc1cncc(N2CCN(CC(=O)N3CCOCC3)CC2)c1
464691,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,20.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464692,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,20.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464693,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,30.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464694,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,60.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464695,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,20.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464696,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,45.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464697,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,60.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464698,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1,321.19212,[M+H]+,20.0,val,Cn1cc(N2CC(C(=O)N3CCOCC3(C)C)CCC2=O)cn1
464699,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,20.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464700,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,20.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464701,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,60.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464702,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,30.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464703,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,20.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464704,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,60.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464705,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,30.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464706,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O,321.19212,[M+H]+,20.0,val,CCN1C(=O)C2CN(Cc3nc(C(C)(C)C)co3)CCN2C1=O
464707,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,321.19212,[M+H]+,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464708,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,321.19212,[M+H]+,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464709,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,321.19212,[M+H]+,60.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464710,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,321.19212,[M+H]+,15.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464711,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1,321.19212,[M+H]+,20.0,val,CC(NC(=O)C1CCCCC1)C(=O)NCc1nc(C2CC2)no1
464712,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464713,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464714,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,30.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464715,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,60.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464716,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464717,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,45.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464718,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,60.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464719,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1,321.19212,[M+H]+,20.0,val,COC(=O)c1nccc(NCCNC(=O)CC2CCCCC2)n1
464720,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464721,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464722,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,60.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464723,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,30.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464724,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464725,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,60.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464726,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,30.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464727,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,321.19212,[M+H]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464728,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,343.17406,[M+Na]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464729,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1,343.17406,[M+Na]+,20.0,val,CCNC(=O)CN1CCCN(C(=O)c2cccn(C)c2=O)CC1
464730,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464731,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464732,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,15.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464733,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,60.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464734,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,30.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464735,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464736,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,60.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464737,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C,321.19212,[M+H]+,20.0,val,CC(NC(=O)CNC(C)(C(N)=O)c1ccccc1)C(=O)N(C)C
464738,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,321.19212,[M+H]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464739,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,321.19212,[M+H]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464740,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,321.19212,[M+H]+,60.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464741,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,321.19212,[M+H]+,15.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464742,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,321.19212,[M+H]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464743,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,343.17406,[M+Na]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464744,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,343.17406,[M+Na]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464745,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,343.17406,[M+Na]+,45.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464746,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,343.17406,[M+Na]+,60.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464747,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1,343.17406,[M+Na]+,20.0,val,CCc1cnc(OC2CCN(C(=O)N3CCOCC3)CC2)nc1
464748,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464749,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464750,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,45.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464751,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,60.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464752,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464753,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,45.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464754,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,60.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464755,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1,321.19212,[M+H]+,20.0,val,Cc1cc(=O)n(CC(=O)NC2CCCC2)c(N2CCOCC2)n1
464756,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464757,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464758,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,30.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464759,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,60.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464760,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,15.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464761,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464762,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464763,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,321.19212,[M+H]+,60.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464764,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464765,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464766,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,343.17406,[M+Na]+,45.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464767,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,343.17406,[M+Na]+,60.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464768,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OC2CCN(C(=O)NCC3CCCO3)CC2)nc1
464769,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464770,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464771,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,60.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464772,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,30.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464773,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464774,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,60.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464775,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,30.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464776,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1,321.19212,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(CCO)CC2)nc1)N1CCOCC1
464777,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464778,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464779,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,321.19212,[M+H]+,60.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464780,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,321.19212,[M+H]+,15.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464781,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,321.19212,[M+H]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464782,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464783,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464784,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,343.17406,[M+Na]+,45.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464785,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,343.17406,[M+Na]+,60.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464786,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1,343.17406,[M+Na]+,20.0,val,Cc1cnc(OCC2CCCN(C(=O)N3CCOCC3)C2)nc1
464787,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464788,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464789,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,60.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464790,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,30.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464791,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464792,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,30.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464793,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,60.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464794,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,321.19212,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464795,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,343.17406,[M+Na]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464796,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,343.17406,[M+Na]+,45.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464797,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1,343.17406,[M+Na]+,20.0,val,COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
464798,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1,321.19212,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1
464799,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1,321.19212,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1
464800,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1,321.19212,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1
464801,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1,321.19212,[M+H]+,15.0,val,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1
464802,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1,321.19212,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2nc(C3CC3)cc(=O)[nH]2)CC1
464803,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,363.16087,[M-H]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464804,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,363.16087,[M-H]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464805,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,363.16087,[M-H]-,60.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464806,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,363.16087,[M-H]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464807,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,363.16087,[M-H]-,45.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464808,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,409.16635,[M+FA]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464809,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,409.16635,[M+FA]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464810,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,409.16635,[M+FA]-,60.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464811,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,409.16635,[M+FA]-,15.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464812,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,409.16635,[M+FA]-,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464813,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464814,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464815,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464816,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464817,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,45.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464818,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464819,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464820,Cc1nn(-c2nc(NC3CCN(S(C)(=O)=O)CC3C)ncc2)c(C)c1,365.17542,[M+H]+,45.0,val,Cc1cc(C)n(-c2ccnc(NC3CCN(S(C)(=O)=O)CC3C)n2)n1
464821,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464822,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464823,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,30.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464824,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,60.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464825,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464826,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,45.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464827,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,60.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464828,CC(C)c1nnc(CNc2ncc(S(=O)(=O)N3CCCC3)cc2)n1C,365.17542,[M+H]+,20.0,val,CC(C)c1nnc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)n1C
464829,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,357.15549,[M+FA]-,20.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464830,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,357.15549,[M+FA]-,60.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464831,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,357.15549,[M+FA]-,15.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464832,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,357.15549,[M+FA]-,20.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464833,Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1,357.15549,[M+FA]-,20.0,val,Cc1ccc(C(C)C)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
464834,Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1,357.15549,[M+FA]-,20.0,val,Cc1ccc(C(C)C)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
464835,Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1,357.15549,[M+FA]-,60.0,val,Cc1ccc(C(C)C)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
464836,Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1,357.15549,[M+FA]-,15.0,val,Cc1ccc(C(C)C)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
464837,Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1,357.15549,[M+FA]-,20.0,val,Cc1ccc(C(C)C)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
464838,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,313.16456,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464839,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,313.16456,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464840,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,313.16456,[M+H]+,60.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464841,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,313.16456,[M+H]+,15.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464842,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1,313.16456,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1
464843,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464844,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464845,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,60.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464846,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,15.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464847,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464848,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,60.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464849,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,15.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464850,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,352.18779,[M+FA]-,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464851,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464852,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464853,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,60.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464854,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464855,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,45.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464856,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,60.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464857,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464858,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,306.18232,[M-H]-,45.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464859,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,342.15899,[M+Cl]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464860,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,342.15899,[M+Cl]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464861,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,342.15899,[M+Cl]-,60.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464862,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,342.15899,[M+Cl]-,15.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464863,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,342.15899,[M+Cl]-,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464864,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,308.19687,[M+H]+,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464865,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,308.19687,[M+H]+,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464866,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,308.19687,[M+H]+,60.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464867,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,308.19687,[M+H]+,15.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464868,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1,308.19687,[M+H]+,20.0,val,CC(C)(C)n1cc(C(=O)NC2(C(=O)O)CCCCCC2)cn1
464869,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464870,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464871,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,60.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464872,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,30.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464873,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464874,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,60.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464875,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,30.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464876,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1,308.19687,[M+H]+,20.0,val,CCc1nc(CNC(=O)NC2CCOC23CCCCC3)co1
464877,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464878,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464879,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,60.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464880,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,30.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464881,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464882,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,60.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464883,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,30.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464884,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,308.19687,[M+H]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464885,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,330.17881,[M+Na]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464886,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,330.17881,[M+Na]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464887,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,330.17881,[M+Na]+,60.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464888,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,330.17881,[M+Na]+,20.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464889,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1,330.17881,[M+Na]+,45.0,val,COCC(C)(C)C(=O)N1CCCC(c2noc(C3CC3)n2)C1
464890,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464891,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464892,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464893,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464894,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464895,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464896,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464897,COCC1(O)CCN(C(=O)c2nn(C3CCCC3)cc2)CC1,308.19687,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2ccn(C3CCCC3)n2)CC1
464898,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,20.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464899,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,20.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464900,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,60.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464901,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,30.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464902,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,20.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464903,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,60.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464904,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,30.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464905,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1,308.19687,[M+H]+,20.0,val,COc1cc(NC2CCCN(C(=O)N(C)C)C2)cc(OC)c1
464906,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,20.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464907,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,20.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464908,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,60.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464909,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,30.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464910,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,20.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464911,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,60.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464912,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,30.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464913,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1,308.19687,[M+H]+,20.0,val,Cc1cnc(COCC(=O)N2CCC3(CCCN3C)CC2)o1
464914,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,20.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464915,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,20.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464916,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,60.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464917,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,30.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464918,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,20.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464919,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,60.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464920,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,30.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464921,COc1cnc(CNC(=O)N2CCC(O)CC(C)(C)C2)cc1,308.19687,[M+H]+,20.0,val,COc1ccc(CNC(=O)N2CCC(O)CC(C)(C)C2)nc1
464922,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,306.18232,[M-H]-,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464923,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,306.18232,[M-H]-,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464924,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,306.18232,[M-H]-,60.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464925,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,306.18232,[M-H]-,30.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464926,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,306.18232,[M-H]-,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464927,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,308.19687,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464928,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,308.19687,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464929,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,308.19687,[M+H]+,60.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464930,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,308.19687,[M+H]+,15.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464931,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1,308.19687,[M+H]+,20.0,val,CN(C)c1ccc(C(=O)NCCCCCCC(=O)NO)cc1
464932,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464933,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464934,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464935,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464936,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,45.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464937,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464938,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464939,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464940,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,30.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464941,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464942,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464943,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464944,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464945,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,306.18232,[M-H]-,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464946,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1,308.19687,[M+H]+,20.0,val,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1
464947,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1,308.19687,[M+H]+,20.0,val,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1
464948,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1,308.19687,[M+H]+,60.0,val,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1
464949,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1,308.19687,[M+H]+,15.0,val,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1
464950,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1,308.19687,[M+H]+,20.0,val,Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)nn1
464951,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464952,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464953,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464954,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,30.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464955,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464956,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,30.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464957,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,20.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464958,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O,308.19687,[M+H]+,60.0,val,CC1CCCCC12NC(=O)N(CC(=O)NC1CCCC1)C2=O
464959,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,20.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464960,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,20.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464961,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,45.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464962,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,60.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464963,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,20.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464964,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,20.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464965,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,45.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464966,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1,308.19687,[M+H]+,60.0,val,CC(=O)Nc1ccc(OCC(O)CN2CCN(C)CC2)cc1
464967,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,20.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464968,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,20.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464969,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,60.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464970,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,30.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464971,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,20.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464972,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,60.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464973,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,30.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464974,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1,340.16894,[M+H]+,20.0,val,COc1ccccc1N1CCN(S(=O)(=O)N2CCC(C)C2)CC1
464975,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,338.15439,[M-H]-,45.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464976,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,338.15439,[M-H]-,45.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464977,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,338.15439,[M-H]-,45.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464978,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,338.15439,[M-H]-,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464979,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,338.15439,[M-H]-,60.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464980,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,384.15987,[M+FA]-,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464981,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,384.15987,[M+FA]-,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464982,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,384.15987,[M+FA]-,60.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464983,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,384.15987,[M+FA]-,15.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464984,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,384.15987,[M+FA]-,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
464985,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464986,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464987,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464988,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,30.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464989,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464990,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,30.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464991,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464992,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,338.15439,[M-H]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464993,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,374.13106,[M+Cl]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464994,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,374.13106,[M+Cl]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464995,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,374.13106,[M+Cl]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464996,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,374.13106,[M+Cl]-,30.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464997,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,374.13106,[M+Cl]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464998,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
464999,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465000,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465001,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465002,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465003,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465004,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465005,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,384.15987,[M+FA]-,15.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465006,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465007,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465008,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465009,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,30.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465010,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465011,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,30.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465012,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,60.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465013,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1,340.16894,[M+H]+,20.0,val,CC(C)NS(=O)(=O)c1ccc(NC(=O)NC2CCCCC2)cc1
465014,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,20.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465015,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,20.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465016,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,60.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465017,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,15.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465018,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,20.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465019,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,20.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465020,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,15.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465021,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1,340.16894,[M+H]+,60.0,val,Cc1ccc(OC2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1
465022,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465023,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465024,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,60.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465025,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,30.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465026,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465027,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,20.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465028,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,30.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465029,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1,340.16894,[M+H]+,60.0,val,Cc1noc(C)c1C(=O)NCC1(N2CCSCC2)CCOCC1
465030,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465031,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465032,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,60.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465033,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,30.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465034,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465035,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465036,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,30.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465037,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1,340.16894,[M+H]+,60.0,val,CC(C)(C)c1ccc(OCC2CCN(S(=O)(=O)C3CC3)C2)nn1
465038,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,588.07496,[M-H]-,20.0,val,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
465039,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,588.07496,[M-H]-,20.0,val,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
465040,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,588.07496,[M-H]-,45.0,val,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
465041,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,588.07496,[M-H]-,60.0,val,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
465042,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,588.07496,[M-H]-,20.0,val,C[C@@H]1OC(OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)nc(N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
465043,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1
465044,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1
465045,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1,312.16279,[M+H]+,60.0,val,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1
465046,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1,312.16279,[M+H]+,15.0,val,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1
465047,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(CNC2(C)CCS(=O)(=O)C2)cc1
465048,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465049,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465050,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,60.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465051,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,30.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465052,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465053,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465054,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,30.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465055,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1,312.16279,[M+H]+,60.0,val,CCCCOc1ccc(S(=O)(=O)N2CCCCCC2)cc1
465056,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465057,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465058,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,30.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465059,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465060,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465061,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465062,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C,312.16279,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)N2CCCCCC2)c(C)c1C
465063,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1
465064,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1
465065,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1,312.16279,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1
465066,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1,312.16279,[M+H]+,15.0,val,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1
465067,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)N(CC)C2CCCCC2)cc1
465068,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465069,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465070,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,60.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465071,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,30.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465072,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465073,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,60.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465074,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,30.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465075,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1,312.16279,[M+H]+,20.0,val,COCCCNS(=O)(=O)c1ccc(C2CCCCC2)cc1
465076,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465077,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465078,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465079,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,30.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465080,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465081,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465082,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465083,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C,312.16279,[M+H]+,30.0,val,COc1c(C)cc(S(=O)(=O)N2CC(C)CC(C)C2)cc1C
465084,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1,342.12031,[M-H]-,20.0,val,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1
465085,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1,342.12031,[M-H]-,20.0,val,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1
465086,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1,342.12031,[M-H]-,30.0,val,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1
465087,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1,342.12031,[M-H]-,20.0,val,CCCc1ccc(S(=O)(=O)NCC2(OC)CCSCC2)cc1
465088,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465089,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465090,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,60.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465091,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,15.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465092,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465093,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,15.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465094,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465095,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,420.15113,[M+FA]-,60.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465096,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,393.18675,[M+NH4]+,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465097,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,393.18675,[M+NH4]+,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465098,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,393.18675,[M+NH4]+,60.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465099,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,393.18675,[M+NH4]+,15.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465100,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O,393.18675,[M+NH4]+,20.0,val,CO[C@H]1[C@@H](OC)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C#N)[C@@H]1O
465101,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,341.17498,[M+Cl]-,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465102,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,341.17498,[M+Cl]-,15.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465103,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,341.17498,[M+Cl]-,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465104,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465105,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,60.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465106,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,15.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465107,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465108,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,60.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465109,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,15.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465110,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,351.20378,[M+FA]-,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465111,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,305.1983,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465112,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,305.1983,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465113,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,305.1983,[M-H]-,60.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465114,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,305.1983,[M-H]-,30.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465115,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,305.1983,[M-H]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465116,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,351.20378,[M+FA]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465117,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,351.20378,[M+FA]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465118,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,351.20378,[M+FA]-,60.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465119,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,351.20378,[M+FA]-,15.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465120,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,351.20378,[M+FA]-,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465121,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,20.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465122,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,20.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465123,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,60.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465124,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,20.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465125,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,45.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465126,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,60.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465127,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,20.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465128,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1,307.21285,[M+H]+,45.0,val,COCCn1c(C2CCC2)nnc1N1CCOC2(CCC2)C1
465129,CCN(CC)CC1CCN(C(=O)Nc2cc(=O)n(C)cc2)C1,307.21285,[M+H]+,20.0,val,CCN(CC)CC1CCN(C(=O)Nc2ccn(C)c(=O)c2)C1
465130,CCN(CC)CC1CCN(C(=O)Nc2cc(=O)n(C)cc2)C1,307.21285,[M+H]+,20.0,val,CCN(CC)CC1CCN(C(=O)Nc2ccn(C)c(=O)c2)C1
465131,CCN(CC)CC1CCN(C(=O)Nc2cc(=O)n(C)cc2)C1,307.21285,[M+H]+,60.0,val,CCN(CC)CC1CCN(C(=O)Nc2ccn(C)c(=O)c2)C1
465132,CCN(CC)CC1CCN(C(=O)Nc2cc(=O)n(C)cc2)C1,307.21285,[M+H]+,15.0,val,CCN(CC)CC1CCN(C(=O)Nc2ccn(C)c(=O)c2)C1
465133,CCN(CC)CC1CCN(C(=O)Nc2cc(=O)n(C)cc2)C1,307.21285,[M+H]+,20.0,val,CCN(CC)CC1CCN(C(=O)Nc2ccn(C)c(=O)c2)C1
465134,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,20.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465135,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,20.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465136,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,60.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465137,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,30.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465138,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,20.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465139,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,60.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465140,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,30.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465141,CC(C)(C(=O)Nc1n[nH]c(C2CCCC2)c1)N1CCOCC1,307.21285,[M+H]+,20.0,val,CC(C)(C(=O)Nc1cc(C2CCCC2)[nH]n1)N1CCOCC1
465142,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465143,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465144,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,60.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465145,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,30.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465146,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465147,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,60.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465148,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,30.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465149,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1,307.21285,[M+H]+,20.0,val,CC1CCCC(C(=O)N2CCCC(O)(Cn3ccnn3)C2)C1
465150,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,20.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465151,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,20.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465152,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,60.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465153,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,30.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465154,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,20.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465155,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,60.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465156,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,30.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465157,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1,307.21285,[M+H]+,20.0,val,Cc1nc(C(=O)NCC2(N3CCCCC3)CCCCC2)no1
465158,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465159,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465160,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,60.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465161,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,30.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465162,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465163,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,60.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465164,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,30.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465165,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1,307.21285,[M+H]+,20.0,val,CC(C)[C@H](N)C(=O)NCC(=O)NCCN(C)c1ccccc1
465166,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465167,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465168,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,30.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465169,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,60.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465170,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465171,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,45.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465172,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,60.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465173,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1,307.21285,[M+H]+,20.0,val,Cc1cc(NC(=O)CN2CCN(CC3(C)CCC3)CC2)no1
465174,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,305.1983,[M-H]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465175,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,305.1983,[M-H]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465176,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,305.1983,[M-H]-,45.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465177,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,305.1983,[M-H]-,60.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465178,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,305.1983,[M-H]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465179,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,351.20378,[M+FA]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465180,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,351.20378,[M+FA]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465181,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,351.20378,[M+FA]-,60.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465182,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,351.20378,[M+FA]-,15.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465183,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,351.20378,[M+FA]-,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465184,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465185,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465186,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,60.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465187,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,30.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465188,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465189,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,30.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465190,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465191,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1,307.21285,[M+H]+,60.0,val,Cc1cnc(N(C)C2CCCN(CC3COCCO3)C2)nc1
465192,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1,307.21285,[M+H]+,20.0,val,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1
465193,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1,307.21285,[M+H]+,20.0,val,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1
465194,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1,307.21285,[M+H]+,60.0,val,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1
465195,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1,307.21285,[M+H]+,15.0,val,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1
465196,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1,307.21285,[M+H]+,20.0,val,COc1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cn1
465197,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,307.21285,[M+H]+,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465198,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,307.21285,[M+H]+,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465199,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,307.21285,[M+H]+,45.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465200,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,307.21285,[M+H]+,60.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465201,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2,307.21285,[M+H]+,20.0,val,Cc1nc2c([nH]1)CC(C(=O)NCCCN1CCOCC1)CC2
465202,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465203,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465204,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,45.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465205,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465206,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465207,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,45.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465208,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465209,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1,307.21285,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NCC1(N2CCOCC2)CCC1
465210,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1,307.21285,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1
465211,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1,307.21285,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1
465212,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1,307.21285,[M+H]+,60.0,val,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1
465213,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1,307.21285,[M+H]+,30.0,val,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1
465214,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1,307.21285,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)CN2CCN(CCO)CC2)cc1
465215,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465216,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465217,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,30.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465218,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,60.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465219,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465220,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,45.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465221,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,60.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465222,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,345.21568,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465223,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465224,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465225,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,60.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465226,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,15.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465227,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465228,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,15.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465229,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465230,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1,347.23023,[M+H]+,60.0,val,CCC(C)C(C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1
465231,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,377.18775,[M-H]-,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465232,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,377.18775,[M-H]-,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465233,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,377.18775,[M-H]-,60.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465234,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,377.18775,[M-H]-,30.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465235,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,377.18775,[M-H]-,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465236,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465237,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465238,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,60.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465239,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465240,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,45.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465241,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,60.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465242,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,20.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465243,CCNc1nc2nnc(SCC(=O)NC3CCCCC3)n2c(NCC)n1,379.2023,[M+H]+,45.0,val,CCNc1nc(NCC)n2c(SCC(=O)NC3CCCCC3)nnc2n1
465244,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465245,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465246,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,60.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465247,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465248,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,45.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465249,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,60.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465250,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,340.17004,[M-H]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465251,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,386.17552,[M+FA]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465252,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,386.17552,[M+FA]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465253,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,386.17552,[M+FA]-,60.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465254,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,386.17552,[M+FA]-,15.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465255,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,386.17552,[M+FA]-,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465256,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,342.18459,[M+H]+,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465257,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,342.18459,[M+H]+,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465258,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,342.18459,[M+H]+,60.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465259,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,342.18459,[M+H]+,30.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465260,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2,342.18459,[M+H]+,20.0,val,CC12CC3CC(C1)CC(C(=O)N1CCN(S(N)(=O)=O)CC1)(C3)C2
465261,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,20.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465262,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,20.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465263,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,60.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465264,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,15.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465265,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,20.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465266,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,60.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465267,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,15.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465268,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1,310.19476,[M+H]+,20.0,val,Cc1nc(C2(NCCSC3CCCCC3)CCCC2)no1
465269,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465270,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465271,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465272,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465273,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,45.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465274,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465275,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465276,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,30.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465277,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465278,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465279,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,45.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465280,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465281,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465282,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465283,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465284,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,45.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465285,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,308.18021,[M-H]-,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465286,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465287,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465288,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,30.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465289,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465290,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465291,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,45.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465292,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,20.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465293,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1,310.19476,[M+H]+,60.0,val,CCCCC(CC)C(=O)Nc1nnc(CC2CCCC2)s1
465294,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465295,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465296,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,60.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465297,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,15.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465298,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465299,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465300,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465301,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,60.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465302,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,15.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465303,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1,354.21358,[M+H]+,20.0,val,CCOC(=O)c1cn(CCN2CCN(C(=O)OC(C)(C)C)CC2)nn1
465304,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1,338.20091,[M+H]+,20.0,val,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1
465305,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1,338.20091,[M+H]+,20.0,val,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1
465306,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1,338.20091,[M+H]+,60.0,val,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1
465307,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1,338.20091,[M+H]+,30.0,val,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1
465308,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1,338.20091,[M+H]+,20.0,val,Cc1nc(CN2CCN(C(=O)NC3CCN(C)CC3)CC2)cs1
465309,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,343.19063,[M+Cl]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465310,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,343.19063,[M+Cl]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465311,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,343.19063,[M+Cl]-,60.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465312,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465313,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465314,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,60.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465315,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,15.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465316,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465317,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,60.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465318,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,15.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465319,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,353.21943,[M+FA]-,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465320,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,353.21943,[M+FA]-,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465321,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,353.21943,[M+FA]-,60.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465322,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,353.21943,[M+FA]-,15.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465323,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,353.21943,[M+FA]-,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465324,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465325,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465326,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,60.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465327,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,30.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465328,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465329,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,60.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465330,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,30.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465331,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C,309.2285,[M+H]+,20.0,val,CCCCn1ncc(NC(=O)NCC2CCOC(C)C2)c1C
465332,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465333,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465334,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,60.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465335,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,30.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465336,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465337,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,60.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465338,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,30.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465339,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,309.2285,[M+H]+,20.0,val,NC(=O)CC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465340,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,379.16097,[M-H]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465341,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,379.16097,[M-H]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465342,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,379.16097,[M-H]-,60.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465343,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,379.16097,[M-H]-,30.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465344,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,379.16097,[M-H]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465345,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,425.16645,[M+FA]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465346,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,425.16645,[M+FA]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465347,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,425.16645,[M+FA]-,60.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465348,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,425.16645,[M+FA]-,15.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465349,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,425.16645,[M+FA]-,20.0,val,C=CC(C)(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
465350,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,346.19029,[M+Cl]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465351,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,346.19029,[M+Cl]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465352,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465353,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465354,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,60.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465355,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,30.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465356,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465357,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,60.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465358,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,30.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465359,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,356.21909,[M+FA]-,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465360,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,346.19029,[M+Cl]-,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465361,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465362,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,60.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465363,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,15.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465364,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465365,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,60.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465366,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,15.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465367,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,356.21909,[M+FA]-,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465368,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465369,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465370,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,30.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465371,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,60.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465372,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,15.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465373,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465374,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,60.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465375,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1,312.22817,[M+H]+,20.0,val,CC(C)CC(=O)N1CCC(NC(=O)NC2CCOCC2)CC1
465376,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465377,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465378,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,60.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465379,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,30.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465380,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465381,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,60.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465382,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,30.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465383,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1,312.22817,[M+H]+,20.0,val,CNC(=O)C1CCC(NC(=O)NC2CCCCC2CO)CC1
465384,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465385,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465386,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465387,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465388,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465389,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465390,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465391,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1,312.22817,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)NC2CCN(C3CC3)CC2)CC1
465392,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,446.20049,[M-H]-,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465393,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,446.20049,[M-H]-,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465394,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,446.20049,[M-H]-,60.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465395,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,446.20049,[M-H]-,30.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465396,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,446.20049,[M-H]-,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465397,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465398,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465399,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,60.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465400,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465401,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,45.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465402,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,60.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465403,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,20.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465404,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,448.21504,[M+H]+,45.0,val,NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
465405,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,20.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465406,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,20.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465407,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,60.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465408,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,20.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465409,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,45.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465410,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,60.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465411,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,20.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465412,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1,283.238,[M+H]+,45.0,val,CC1(C)CCC(C)(C)N(C(=O)COC2CCNCC2)C1
465413,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12,237.2213,[M+H-H2O]+,30.0,val,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
465414,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12,237.2213,[M+H-H2O]+,30.0,val,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
465415,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12,237.2213,[M+H-H2O]+,20.0,val,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
465416,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12,237.2213,[M+H-H2O]+,60.0,val,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
465417,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12,237.2213,[M+H-H2O]+,30.0,val,CC1(C)CCC[C@]2(C)[C@@H](CCO)[C@](C)(O)CC[C@@H]12
465418,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,20.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465419,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,20.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465420,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,60.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465421,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,20.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465422,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,60.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465423,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3c(cc(Cl)cc3)n12,381.01831,[M+H]+,20.0,val,FC(F)(F)c1nnc2c(Sc3ccccc3)nc3ccc(Cl)cc3n12
465424,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465425,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465426,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465427,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465428,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,60.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465429,O=C(Nc1ccc(C(F)(F)F)cc1)c1c2nc(C(F)(F)F)[nH]c2cc(Cl)c1,406.01873,[M-H]-,20.0,val,O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)cc2[nH]c(C(F)(F)F)nc12
465430,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1,326.08479,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1
465431,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1,326.08479,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1
465432,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1,326.08479,[M+H]+,60.0,val,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1
465433,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1,326.08479,[M+H]+,30.0,val,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1
465434,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1,326.08479,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3cn(-c4ccc(F)cc4)nn3)no2)cc1
465435,Cc1c2c(N)c(C(=O)c3c(F)cc(F)cc3)sc2nc(C(F)(F)F)c1,373.04285,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)nc2sc(C(=O)c3ccc(F)cc3F)c(N)c12
465436,Cc1c2c(N)c(C(=O)c3c(F)cc(F)cc3)sc2nc(C(F)(F)F)c1,373.04285,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)nc2sc(C(=O)c3ccc(F)cc3F)c(N)c12
465437,Cc1c2c(N)c(C(=O)c3c(F)cc(F)cc3)sc2nc(C(F)(F)F)c1,373.04285,[M+H]+,60.0,val,Cc1cc(C(F)(F)F)nc2sc(C(=O)c3ccc(F)cc3F)c(N)c12
465438,Cc1c2c(N)c(C(=O)c3c(F)cc(F)cc3)sc2nc(C(F)(F)F)c1,373.04285,[M+H]+,20.0,val,Cc1cc(C(F)(F)F)nc2sc(C(=O)c3ccc(F)cc3F)c(N)c12
465439,Cc1c2c(N)c(C(=O)c3c(F)cc(F)cc3)sc2nc(C(F)(F)F)c1,373.04285,[M+H]+,45.0,val,Cc1cc(C(F)(F)F)nc2sc(C(=O)c3ccc(F)cc3F)c(N)c12
465440,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465441,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465442,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,60.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465443,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,30.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465444,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465445,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465446,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,30.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465447,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1,338.01603,[M-H]-,60.0,val,N#Cc1ccc(NC(=O)c2sc(Cl)nc2-c2ccccc2)cc1
465448,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465449,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465450,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,60.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465451,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,30.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465452,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465453,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,30.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465454,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,20.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465455,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1,338.01603,[M-H]-,60.0,val,N#Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1
465456,O=C(O)Cc1nn(Cc2nc3c(ccc(C(F)(F)F)c3)s2)c(=O)c2cscc12,426.01884,[M+H]+,20.0,val,O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2cscc12
465457,O=C(O)Cc1nn(Cc2nc3c(ccc(C(F)(F)F)c3)s2)c(=O)c2cscc12,426.01884,[M+H]+,20.0,val,O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2cscc12
465458,O=C(O)Cc1nn(Cc2nc3c(ccc(C(F)(F)F)c3)s2)c(=O)c2cscc12,426.01884,[M+H]+,60.0,val,O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2cscc12
465459,O=C(O)Cc1nn(Cc2nc3c(ccc(C(F)(F)F)c3)s2)c(=O)c2cscc12,426.01884,[M+H]+,30.0,val,O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2cscc12
465460,O=C(O)Cc1nn(Cc2nc3c(ccc(C(F)(F)F)c3)s2)c(=O)c2cscc12,426.01884,[M+H]+,20.0,val,O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2cscc12
465461,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1,323.01784,[M+H]+,20.0,val,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1
465462,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1,323.01784,[M+H]+,20.0,val,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1
465463,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1,323.01784,[M+H]+,60.0,val,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1
465464,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1,323.01784,[M+H]+,20.0,val,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1
465465,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1,323.01784,[M+H]+,60.0,val,Brc1ccc(-c2cn3c(ccc4ccccc43)n2)cc1
465466,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1,420.95476,[M-H]-,20.0,val,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1
465467,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1,420.95476,[M-H]-,20.0,val,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1
465468,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1,420.95476,[M-H]-,45.0,val,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1
465469,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1,420.95476,[M-H]-,60.0,val,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1
465470,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1,420.95476,[M-H]-,20.0,val,CS(=O)(=O)c1ccc2nc(NC(=O)c3sc4ccccc4c3Cl)sc2c1
465471,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465472,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465473,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465474,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465475,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,45.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465476,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465477,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465478,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,45.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465479,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465480,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465481,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465482,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,30.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465483,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465484,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465485,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465486,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,45.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465487,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465488,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465489,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465490,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,45.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465491,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,314.06342,[M-H]-,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465492,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465493,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,60.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465494,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1,316.07798,[M+H]+,20.0,val,COc1ccc(C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1
465495,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,20.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465496,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,20.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465497,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,60.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465498,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,30.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465499,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,20.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465500,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,30.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465501,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,20.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465502,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1,322.06447,[M+H]+,60.0,val,O=c1c2cc(-c3ccccc3)sc2ncn1N=Cc1ccco1
465503,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,20.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465504,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,20.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465505,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,60.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465506,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,20.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465507,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,20.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465508,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1,294.07608,[M+H]+,60.0,val,COc1cccc2c1cc1c3c(cc4c(c32)OCO4)C(=O)N1
465509,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1,310.071,[M+H]+,20.0,val,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1
465510,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1,310.071,[M+H]+,20.0,val,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1
465511,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1,310.071,[M+H]+,60.0,val,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1
465512,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1,310.071,[M+H]+,15.0,val,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1
465513,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1,310.071,[M+H]+,20.0,val,O=C(OCc1cc(-c2ccco2)on1)c1cc2ccccc2o1
465514,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,356.04119,[M-H]-,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465515,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,356.04119,[M-H]-,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465516,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,356.04119,[M-H]-,60.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465517,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,356.04119,[M-H]-,15.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465518,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,356.04119,[M-H]-,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465519,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,340.04518,[M+H-H2O]+,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465520,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,340.04518,[M+H-H2O]+,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465521,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,340.04518,[M+H-H2O]+,60.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465522,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,340.04518,[M+H-H2O]+,30.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465523,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3,340.04518,[M+H-H2O]+,20.0,val,COc1cc(O)cc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3
465524,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,45.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465525,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,45.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465526,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,20.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465527,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,60.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465528,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,45.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465529,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,20.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465530,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,20.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465531,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,45.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465532,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,60.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465533,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,20.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465534,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,60.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465535,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,45.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465536,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl,363.01201,[M+H]+,20.0,val,O=C1CC2Sc3ccccc3N=C2N1Cc1c(Cl)cccc1Cl
465537,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465538,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,60.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465539,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465540,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,45.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465541,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,60.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465542,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465543,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,276.09425,[M-H]-,45.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465544,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,312.07093,[M+Cl]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465545,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,312.07093,[M+Cl]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465546,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,312.07093,[M+Cl]-,15.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465547,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,312.07093,[M+Cl]-,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465548,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,277.10153,[M]+,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465549,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,277.10153,[M]+,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465550,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,277.10153,[M]+,60.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465551,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,277.10153,[M]+,20.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465552,N#Cc1c(N)[nH]c2c1ccc(/C=C/c1cc(F)ccc1)c2,277.10153,[M]+,60.0,val,N#Cc1c(N)[nH]c2cc(/C=C/c3cccc(F)c3)ccc12
465553,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465554,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465555,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,45.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465556,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,60.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465557,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465558,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,45.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465559,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,60.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465560,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2,344.03983,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(Oc2cc(F)cc(C#N)c2)c2c1C(=O)CC2
465561,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12,318.04469,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12
465562,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12,318.04469,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12
465563,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12,318.04469,[M+H]+,60.0,val,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12
465564,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12,318.04469,[M+H]+,30.0,val,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12
465565,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12,318.04469,[M+H]+,20.0,val,Cc1cc(=O)n(Cc2ccc(Cl)cc2Cl)c2ccccc12
465566,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,300.03413,[M+H-H2O]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465567,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,300.03413,[M+H-H2O]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465568,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,300.03413,[M+H-H2O]+,60.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465569,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,300.03413,[M+H-H2O]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465570,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,300.03413,[M+H-H2O]+,60.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465571,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,318.04469,[M+H]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465572,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,318.04469,[M+H]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465573,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,318.04469,[M+H]+,60.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465574,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,318.04469,[M+H]+,15.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465575,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1,318.04469,[M+H]+,20.0,val,OC(Cc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1
465576,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,20.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465577,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,20.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465578,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,60.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465579,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,30.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465580,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,20.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465581,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,60.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465582,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,30.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465583,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl,398.01927,[M+H]+,20.0,val,COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl
465584,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,20.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465585,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,20.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465586,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,60.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465587,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,30.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465588,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,20.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465589,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,60.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465590,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,30.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465591,COC(=O)c1c(S(=O)(=O)Nc2cc(Cl)c(C)cc2)c2c(F)cccc2s1,411.98858,[M-H]-,20.0,val,COC(=O)c1sc2cccc(F)c2c1S(=O)(=O)Nc1ccc(C)c(Cl)c1
465592,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465593,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465594,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,60.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465595,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,30.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465596,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465597,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,60.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465598,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,30.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465599,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,355.06034,[M-H]-,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465600,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465601,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465602,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,60.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465603,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465604,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,45.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465605,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,60.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465606,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,20.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465607,Cc1nn(-c2ccccc2)c(NC(=O)c2c(Cl)ccc([N+](=O)[O-])c2)c1,357.07489,[M+H]+,45.0,val,Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n(-c2ccccc2)n1
465608,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,335.10621,[M-H]-,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465609,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,335.10621,[M-H]-,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465610,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,335.10621,[M-H]-,60.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465611,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,335.10621,[M-H]-,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465612,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,335.10621,[M-H]-,45.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465613,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,381.11169,[M+FA]-,30.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465614,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,381.11169,[M+FA]-,30.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465615,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,381.11169,[M+FA]-,60.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465616,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,381.11169,[M+FA]-,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465617,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,381.11169,[M+FA]-,30.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465618,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465619,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465620,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,60.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465621,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,30.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465622,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465623,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,60.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465624,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,30.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465625,Fc1c(Oc2cnccc2)ccc(CNc2c3cn[nH]c3ncn2)c1,337.12076,[M+H]+,20.0,val,Fc1cc(CNc2ncnc3[nH]ncc23)ccc1Oc1cccnc1
465626,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465627,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465628,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,60.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465629,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,15.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465630,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465631,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,45.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465632,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,60.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465633,Cc1cc2c(cc1)ncnc2Oc1ccc(-n2cncn2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc2ncnc(Oc3ccc(-n4cncn4)cc3)c2c1
465634,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12,304.11929,[M+H]+,20.0,val,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12
465635,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12,304.11929,[M+H]+,20.0,val,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12
465636,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12,304.11929,[M+H]+,60.0,val,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12
465637,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12,304.11929,[M+H]+,20.0,val,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12
465638,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12,304.11929,[M+H]+,60.0,val,Nc1ncnc2n[nH]c(-c3ccc(Oc4ccccc4)cc3)c12
465639,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1,302.10473,[M-H]-,20.0,val,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1
465640,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1,302.10473,[M-H]-,20.0,val,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1
465641,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1,302.10473,[M-H]-,45.0,val,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1
465642,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1,302.10473,[M-H]-,60.0,val,N#Cc1cccc(NC(=O)c2cc(C3CC3)n3nccc3n2)c1
465643,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,20.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465644,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,20.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465645,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,60.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465646,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,30.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465647,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,20.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465648,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,20.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465649,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,30.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465650,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,302.10473,[M-H]-,60.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465651,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1
465652,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1
465653,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1,304.11929,[M+H]+,60.0,val,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1
465654,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1
465655,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1,304.11929,[M+H]+,60.0,val,COc1ccc(-c2nc3nccc(-c4ccncc4)n3n2)cc1
465656,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465657,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465658,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,60.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465659,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465660,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,60.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465661,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,COc1ccc(-c2nc3nccc(-c4cccnc4)n3n2)cc1
465662,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,304.11929,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465663,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,304.11929,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465664,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465665,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,304.11929,[M+H]+,60.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465666,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1,304.11929,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2-c2c[nH]c3ccccc3c2=O)cc1
465667,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1
465668,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1
465669,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1,304.11929,[M+H]+,45.0,val,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1
465670,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1,304.11929,[M+H]+,60.0,val,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1
465671,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1,304.11929,[M+H]+,20.0,val,Cc1ccc(-c2nc(-c3ccc(-n4cccn4)nc3)no2)cc1
465672,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,20.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465673,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,20.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465674,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,60.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465675,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,30.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465676,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,20.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465677,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,60.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465678,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,30.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465679,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1,304.11929,[M+H]+,20.0,val,O=c1c2nnn(Cc3ccccc3)c2ncn1-c1ccccc1
465680,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1
465681,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1
465682,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,45.0,val,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1
465683,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,60.0,val,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1
465684,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1,304.11929,[M+H]+,20.0,val,c1ccc(OCc2nc3nccc(-c4cccnc4)n3n2)cc1
465685,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21,304.11929,[M+H]+,20.0,val,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21
465686,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21,304.11929,[M+H]+,20.0,val,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21
465687,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21,304.11929,[M+H]+,60.0,val,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21
465688,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21,304.11929,[M+H]+,15.0,val,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21
465689,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21,304.11929,[M+H]+,20.0,val,Cn1cc(-c2nnnn2-c2ccccc2)c(=O)c2ccccc21
465690,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465691,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465692,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465693,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465694,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465695,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1,344.04096,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)OCC(=O)c1cccs1
465696,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,366.09301,[M-H]-,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465697,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,366.09301,[M-H]-,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465698,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,366.09301,[M-H]-,60.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465699,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,366.09301,[M-H]-,30.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465700,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,366.09301,[M-H]-,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465701,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,368.10756,[M+H]+,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465702,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,368.10756,[M+H]+,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465703,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,368.10756,[M+H]+,60.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465704,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,368.10756,[M+H]+,30.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465705,CC1(C)OB(O)c2c1ccc(NC(=O)c1c(C(F)(F)F)cc(F)cc1)c2,368.10756,[M+H]+,20.0,val,CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21
465706,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,20.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465707,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,20.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465708,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,60.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465709,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,20.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465710,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,45.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465711,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,60.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465712,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,20.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465713,Cc1c(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)ccc(Br)c1,433.98156,[M-H]-,45.0,val,Cc1cc(Br)ccc1CC(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1
465714,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,331.06551,[M-H]-,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465715,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,331.06551,[M-H]-,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465716,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,331.06551,[M-H]-,60.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465717,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,331.06551,[M-H]-,15.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465718,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,331.06551,[M-H]-,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465719,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,333.08006,[M+H]+,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465720,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,333.08006,[M+H]+,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465721,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,333.08006,[M+H]+,45.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465722,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,333.08006,[M+H]+,60.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465723,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21,333.08006,[M+H]+,20.0,val,CCN1C(=O)Cc2cc(NC(=O)c3c(F)cccc3Cl)ccc21
465724,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465725,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465726,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,45.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465727,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,60.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465728,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465729,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465730,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,45.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465731,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,310.07526,[M-H]-,60.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465732,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,346.05194,[M+Cl]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465733,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,346.05194,[M+Cl]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465734,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,346.05194,[M+Cl]-,60.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465735,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,346.05194,[M+Cl]-,30.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465736,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,346.05194,[M+Cl]-,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465737,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1,310.07526,[M-H]-,20.0,val,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1
465738,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1,310.07526,[M-H]-,20.0,val,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1
465739,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1,310.07526,[M-H]-,45.0,val,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1
465740,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1,310.07526,[M-H]-,60.0,val,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1
465741,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1,310.07526,[M-H]-,20.0,val,Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cccn2)cc1
465742,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465743,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465744,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,45.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465745,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,60.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465746,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465747,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,45.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465748,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,60.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465749,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1,312.08982,[M+H]+,20.0,val,O=C(NCc1cccc(Cl)c1)c1cccn1-c1cccnc1
465750,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,20.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465751,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,20.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465752,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,60.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465753,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,15.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465754,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,20.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465755,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,45.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465756,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,60.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465757,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1,312.08982,[M+H]+,20.0,val,O=c1c(Cl)c(NCc2ccccc2)cnn1-c1ccccc1
465758,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1,312.08982,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1
465759,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1,312.08982,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1
465760,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1,312.08982,[M+H]+,60.0,val,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1
465761,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1,312.08982,[M+H]+,30.0,val,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1
465762,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1,312.08982,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2[nH]ccc2c1
465763,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,20.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465764,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,20.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465765,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,60.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465766,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,30.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465767,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,20.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465768,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,30.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465769,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,60.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465770,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1,312.08982,[M+H]+,20.0,val,CCc1nc2ccccc2c(=O)n1/N=C/c1ccc(Cl)cc1
465771,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465772,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465773,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,60.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465774,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,15.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465775,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465776,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,45.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465777,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,60.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465778,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C,312.08982,[M+H]+,20.0,val,Cc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2nc1C
465779,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1,356.07312,[M+H]+,20.0,val,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1
465780,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1,356.07312,[M+H]+,20.0,val,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1
465781,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1,356.07312,[M+H]+,45.0,val,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1
465782,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1,356.07312,[M+H]+,60.0,val,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1
465783,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1,356.07312,[M+H]+,20.0,val,N#Cc1cnc(N2CCN(c3nc4ccccc4s3)CC2)c(Cl)c1
465784,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,20.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465785,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,20.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465786,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,45.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465787,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,60.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465788,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,20.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465789,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,60.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465790,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,45.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465791,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1,356.07312,[M+H]+,20.0,val,Clc1cccc(N2C=Nn3c(nnc3SCc3ccccc3)C2)c1
465792,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O,344.10411,[M+H]+,30.0,val,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O
465793,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O,344.10411,[M+H]+,30.0,val,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O
465794,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O,344.10411,[M+H]+,20.0,val,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O
465795,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O,344.10411,[M+H]+,60.0,val,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O
465796,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O,344.10411,[M+H]+,30.0,val,CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O
465797,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465798,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465799,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,60.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465800,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,30.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465801,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465802,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,60.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465803,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,30.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465804,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,338.10588,[M-H]-,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465805,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,340.12043,[M+H]+,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465806,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,340.12043,[M+H]+,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465807,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,340.12043,[M+H]+,60.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465808,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,340.12043,[M+H]+,30.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465809,O=C(Nc1n[nH]c(C2CC2)c1)c1nn(-c2ccc(F)cc2)c(=O)cc1,340.12043,[M+H]+,20.0,val,O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(=O)n(-c2ccc(F)cc2)n1
465810,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465811,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465812,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,60.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465813,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,30.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465814,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465815,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,60.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465816,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,30.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465817,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,309.07032,[M-H]-,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465818,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465819,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465820,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,60.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465821,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,30.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465822,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465823,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,60.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465824,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,30.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465825,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1,311.08488,[M+H]+,20.0,val,Cc1cc(=O)nc(SCC(=O)c2cccc3ccccc23)[nH]1
465826,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465827,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465828,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,60.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465829,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465830,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,45.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465831,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,60.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465832,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465833,Cn1c2c(CCc3ccccc3-2)s/c1=N/C(=O)c1ccco1,311.08488,[M+H]+,45.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465834,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,309.07032,[M-H]-,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465835,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,309.07032,[M-H]-,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465836,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,309.07032,[M-H]-,45.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465837,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,309.07032,[M-H]-,60.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465838,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,309.07032,[M-H]-,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465839,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,309.07032,[M-H]-,30.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465840,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,309.07032,[M-H]-,30.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465841,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,309.07032,[M-H]-,20.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465842,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,309.07032,[M-H]-,60.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465843,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,309.07032,[M-H]-,30.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465844,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,310.07705,[M]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465845,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,310.07705,[M]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465846,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,310.07705,[M]+,60.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465847,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,310.07705,[M]+,30.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465848,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,310.07705,[M]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465849,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465850,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465851,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,45.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465852,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,60.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465853,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465854,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,60.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465855,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2,311.08488,[M+H]+,20.0,val,c1ccc2c(c1)CCN(c1nc3cc4c(cc3s1)OCO4)C2
465856,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12,311.08488,[M+H]+,30.0,val,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12
465857,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12,311.08488,[M+H]+,30.0,val,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12
465858,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12,311.08488,[M+H]+,20.0,val,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12
465859,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12,311.08488,[M+H]+,60.0,val,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12
465860,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12,311.08488,[M+H]+,30.0,val,Cc1nnc(SC(C(=O)O)c2ccccc2)c2ccccc12
465861,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465862,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465863,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,60.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465864,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,30.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465865,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465866,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,60.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465867,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,30.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465868,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1,311.08488,[M+H]+,20.0,val,O=C(Nc1cc(-c2ccsc2)no1)C1(c2ccccc2)CC1
465869,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465870,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465871,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,45.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465872,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,60.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465873,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465874,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,45.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465875,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,60.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465876,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2,311.08488,[M+H]+,20.0,val,Cn1c2c(s/c1=N/C(=O)c1ccco1)CCc1ccccc1-2
465877,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,311.08488,[M+H]+,20.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465878,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,311.08488,[M+H]+,20.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465879,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,311.08488,[M+H]+,60.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465880,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,311.08488,[M+H]+,20.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465881,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1,311.08488,[M+H]+,60.0,val,COc1ccc(NC(=O)c2ccc(-c3ccsc3)nc2)cc1
465882,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465883,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465884,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,60.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465885,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465886,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,45.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465887,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,60.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465888,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465889,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,341.06015,[M-H]-,45.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465890,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,341.06015,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465891,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,341.06015,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465892,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,341.06015,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465893,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,341.06015,[M-H]-,30.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465894,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,341.06015,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465895,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465896,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465897,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465898,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465899,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465900,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,60.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465901,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,30.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465902,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1,343.0747,[M+H]+,20.0,val,Cc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c2ncccc2c1
465903,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,343.0747,[M+H]+,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465904,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,343.0747,[M+H]+,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465905,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,343.0747,[M+H]+,60.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465906,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,343.0747,[M+H]+,15.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465907,Cc1c(NS(=O)(=O)c2cc3c(cc2)nccc3)ccc(C(=O)O)c1,343.0747,[M+H]+,20.0,val,Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2ncccc2c1
465908,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,20.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465909,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,20.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465910,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,30.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465911,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,60.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465912,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,20.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465913,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,45.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465914,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,60.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465915,O=C(/C=C/C#Cc1cc(NS(=O)(=O)c2ccccc2)ccc1)NO,341.06015,[M-H]-,20.0,val,O=C(/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1)NO
465916,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465917,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465918,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,60.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465919,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,15.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465920,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465921,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,60.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465922,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,20.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465923,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,343.0747,[M+H]+,15.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465924,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,365.05665,[M+Na]+,30.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465925,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,365.05665,[M+Na]+,30.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465926,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,365.05665,[M+Na]+,20.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465927,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12,365.05665,[M+Na]+,30.0,val,COC(=O)c1sccc1NC(=O)COc1cccc2cccnc12
465928,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,20.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465929,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,20.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465930,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,60.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465931,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,30.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465932,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,20.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465933,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,60.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465934,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,30.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465935,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1,327.06203,[M+H]+,20.0,val,Cc1ccccc1-c1nsc(SCC(=O)c2ccccc2)n1
465936,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,369.04854,[M-H]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465937,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,369.04854,[M-H]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465938,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,369.04854,[M-H]-,60.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465939,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,369.04854,[M-H]-,30.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465940,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,369.04854,[M-H]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465941,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465942,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465943,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,60.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465944,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,15.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465945,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465946,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,60.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465947,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,15.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465948,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,415.05402,[M+FA]-,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465949,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,371.06309,[M+H]+,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465950,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,371.06309,[M+H]+,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465951,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,371.06309,[M+H]+,60.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465952,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,371.06309,[M+H]+,15.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465953,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1,371.06309,[M+H]+,20.0,val,NC(=O)CSc1nnc(CN2c3ccccc3Sc3ccccc32)o1
465954,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,20.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465955,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,20.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465956,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,60.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465957,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,20.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465958,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,60.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465959,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1,307.10119,[M+H]+,20.0,val,c1ccc(CCc2nc3nccc(-c4ccsc4)n3n2)cc1
465960,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,20.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465961,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,20.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465962,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,60.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465963,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,30.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465964,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,20.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465965,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,30.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465966,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,60.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465967,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1,307.10119,[M+H]+,20.0,val,Cc1cccc(-c2nc3n(n2)N=C(c2ccccc2)CS3)c1
465968,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,20.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465969,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,20.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465970,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,45.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465971,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,60.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465972,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,20.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465973,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,60.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465974,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,45.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465975,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1,307.10119,[M+H]+,20.0,val,C1=C(c2ccccc2)Sc2nnc(-c3ccccc3)n2NC1
465976,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,20.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465977,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,20.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465978,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,60.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465979,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,20.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465980,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,60.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465981,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3,307.10119,[M+H]+,20.0,val,Cc1nc(-n2cnc3ccccc32)c2c3c(sc2n1)CCC3
465982,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21,307.10119,[M+H]+,20.0,val,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21
465983,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21,307.10119,[M+H]+,20.0,val,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21
465984,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21,307.10119,[M+H]+,60.0,val,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21
465985,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21,307.10119,[M+H]+,30.0,val,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21
465986,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21,307.10119,[M+H]+,20.0,val,Cn1c2ccccc2c2nnc(SCc3ccccc3)nc21
465987,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,20.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465988,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,20.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465989,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,60.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465990,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,30.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465991,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,20.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465992,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,30.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465993,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,60.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465994,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1,307.10119,[M+H]+,20.0,val,Cc1nc(SCc2nc3ccccc3[nH]2)c2ccccc2n1
465995,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1,307.10119,[M+H]+,20.0,val,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1
465996,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1,307.10119,[M+H]+,20.0,val,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1
465997,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1,307.10119,[M+H]+,45.0,val,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1
465998,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1,307.10119,[M+H]+,60.0,val,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1
465999,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1,307.10119,[M+H]+,20.0,val,Cc1cc(C)n(-c2ncnc3sc(-c4ccccc4)cc23)n1
466000,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466001,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466002,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466003,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,30.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466004,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466005,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466006,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,30.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466007,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,402.03712,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466008,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,438.0138,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466009,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,438.0138,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466010,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,448.0426,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466011,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,448.0426,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466012,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,448.0426,[M+FA]-,60.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466013,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,448.0426,[M+FA]-,15.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466014,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,448.0426,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466015,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,404.05168,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466016,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,404.05168,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466017,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,404.05168,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466018,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,404.05168,[M+H]+,15.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466019,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1,404.05168,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c(Br)c1
466020,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,417.00263,[M-H]-,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466021,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,417.00263,[M-H]-,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466022,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,417.00263,[M-H]-,60.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466023,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,417.00263,[M-H]-,15.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466024,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,417.00263,[M-H]-,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466025,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,419.01718,[M+H]+,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466026,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,419.01718,[M+H]+,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466027,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,419.01718,[M+H]+,60.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466028,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,419.01718,[M+H]+,30.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466029,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1c(O)ccc(Br)c1,419.01718,[M+H]+,20.0,val,CC(Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1cc(Br)ccc1O
466030,Cn1cc(Br)c(C(=O)Nc2c(C(N)=O)cc(Cc3ccccc3)s2)n1,417.00263,[M-H]-,20.0,val,Cn1cc(Br)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)n1
466031,Cn1cc(Br)c(C(=O)Nc2c(C(N)=O)cc(Cc3ccccc3)s2)n1,417.00263,[M-H]-,20.0,val,Cn1cc(Br)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)n1
466032,Cn1cc(Br)c(C(=O)Nc2c(C(N)=O)cc(Cc3ccccc3)s2)n1,417.00263,[M-H]-,60.0,val,Cn1cc(Br)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)n1
466033,Cn1cc(Br)c(C(=O)Nc2c(C(N)=O)cc(Cc3ccccc3)s2)n1,417.00263,[M-H]-,30.0,val,Cn1cc(Br)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)n1
466034,Cn1cc(Br)c(C(=O)Nc2c(C(N)=O)cc(Cc3ccccc3)s2)n1,417.00263,[M-H]-,20.0,val,Cn1cc(Br)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)n1
466035,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1,320.10928,[M+H]+,15.0,val,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1
466036,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1,320.10928,[M+H]+,15.0,val,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1
466037,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1,320.10928,[M+H]+,60.0,val,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1
466038,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1,320.10928,[M+H]+,20.0,val,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1
466039,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1,320.10928,[M+H]+,15.0,val,CCc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)cc1
466040,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,334.08964,[M-H]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466041,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,334.08964,[M-H]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466042,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,334.08964,[M-H]-,60.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466043,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,334.08964,[M-H]-,30.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466044,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,334.08964,[M-H]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466045,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,370.06632,[M+Cl]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466046,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466047,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466048,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,60.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466049,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,15.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466050,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466051,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,20.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466052,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,15.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466053,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2,380.09512,[M+FA]-,60.0,val,CC(O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2
466054,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,20.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466055,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,20.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466056,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,45.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466057,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,60.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466058,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,20.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466059,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,20.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466060,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,60.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466061,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1,278.12879,[M+H]+,45.0,val,Cc1ccc(-n2cnc(N)c2C(=O)c2ccccc2)cc1
466062,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,308.10406,[M-H]-,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466063,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,308.10406,[M-H]-,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466064,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,308.10406,[M-H]-,60.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466065,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,308.10406,[M-H]-,15.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466066,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,308.10406,[M-H]-,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466067,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466068,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466069,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,60.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466070,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,30.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466071,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466072,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,60.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466073,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,30.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466074,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,308.10406,[M-H]-,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466075,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,310.11862,[M+H]+,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466076,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,310.11862,[M+H]+,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466077,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,310.11862,[M+H]+,60.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466078,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,310.11862,[M+H]+,30.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466079,Cc1cc2c(cc1)C(=O)N(C(C)C(=O)Nc1cnccc1)C2=O,310.11862,[M+H]+,20.0,val,Cc1ccc2c(c1)C(=O)N(C(C)C(=O)Nc1cccnc1)C2=O
466080,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,310.11862,[M+H]+,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466081,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,310.11862,[M+H]+,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466082,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,310.11862,[M+H]+,60.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466083,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,310.11862,[M+H]+,15.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466084,O=C(NCC(C(=O)O)c1ccccc1)c1c2ccccn2nc1,310.11862,[M+H]+,20.0,val,O=C(NCC(C(=O)O)c1ccccc1)c1cnn2ccccc12
466085,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1,310.11862,[M+H]+,30.0,val,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1
466086,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1,310.11862,[M+H]+,30.0,val,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1
466087,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1,310.11862,[M+H]+,60.0,val,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1
466088,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1
466089,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1,310.11862,[M+H]+,30.0,val,COc1ccc(NC(=O)c2cnc3c(C)cccn3c2=O)cc1
466090,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466091,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466092,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466093,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466094,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466095,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,60.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466096,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466097,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,45.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466098,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,60.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466099,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466100,COc1c(C(=O)NCc2cc(-c3ccco3)ncc2)cccn1,310.11862,[M+H]+,45.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466101,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466102,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466103,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,310.11862,[M+H]+,60.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466104,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466105,COc1ccc(C2(c3nc(-c4c[nH]c(=O)cc4)no3)CC2)cc1,310.11862,[M+H]+,45.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466106,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466107,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466108,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,308.10406,[M-H]-,60.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466109,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,308.10406,[M-H]-,15.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466110,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,308.10406,[M-H]-,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466111,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466112,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466113,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,30.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466114,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,60.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466115,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466116,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,45.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466117,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466118,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,308.10406,[M-H]-,60.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466119,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,344.08074,[M+Cl]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466120,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,344.08074,[M+Cl]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466121,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,344.08074,[M+Cl]-,15.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466122,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,344.08074,[M+Cl]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466123,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,354.10954,[M+FA]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466124,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,354.10954,[M+FA]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466125,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,354.10954,[M+FA]-,15.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466126,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,354.10954,[M+FA]-,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466127,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1,310.11862,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1
466128,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1,310.11862,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1
466129,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1,310.11862,[M+H]+,60.0,val,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1
466130,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1,310.11862,[M+H]+,15.0,val,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1
466131,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1,310.11862,[M+H]+,20.0,val,Cc1ccc2nc(C(=O)NCc3ccc4c(c3)OCO4)cn2c1
466132,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21,310.11862,[M+H]+,20.0,val,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21
466133,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21,310.11862,[M+H]+,20.0,val,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21
466134,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21,310.11862,[M+H]+,60.0,val,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21
466135,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21,310.11862,[M+H]+,15.0,val,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21
466136,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21,310.11862,[M+H]+,20.0,val,Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21
466137,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O,310.11862,[M+H]+,20.0,val,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O
466138,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O,310.11862,[M+H]+,20.0,val,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O
466139,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O,310.11862,[M+H]+,45.0,val,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O
466140,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O,310.11862,[M+H]+,60.0,val,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O
466141,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O,310.11862,[M+H]+,20.0,val,COc1ccccc1NC(=O)c1cnc2ccc(C)cn2c1=O
466142,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466143,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466144,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,60.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466145,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,15.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466146,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466147,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,20.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466148,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,15.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466149,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1,310.11862,[M+H]+,60.0,val,O=C(CCn1c(=O)oc2ccccc21)N/N=C/c1ccccc1
466150,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466151,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466152,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466153,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,30.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466154,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466155,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,30.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466156,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466157,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O,310.11862,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCn1nc(C2CC2)ccc1=O
466158,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466159,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466160,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,45.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466161,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,60.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466162,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466163,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,45.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466164,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,60.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466165,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(C2(c3nc(-c4ccc(=O)[nH]c4)no3)CC2)cc1
466166,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,20.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466167,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,20.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466168,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,60.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466169,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,30.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466170,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,20.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466171,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,60.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466172,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,20.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466173,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O,310.11862,[M+H]+,30.0,val,Cn1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1=O
466174,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,30.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466175,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,30.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466176,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,20.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466177,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,60.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466178,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,30.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466179,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,60.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466180,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,20.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466181,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1,310.11862,[M+H]+,30.0,val,O=C1CC(c2noc(-c3ccco3)n2)CN1Cc1ccccc1
466182,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466183,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466184,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,60.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466185,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466186,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466187,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466188,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,60.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466189,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1,310.11862,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cc2ccccc2o1)c1ccccn1
466190,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466191,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466192,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,45.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466193,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,60.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466194,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466195,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,60.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466196,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,45.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466197,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1,310.11862,[M+H]+,20.0,val,COc1ncccc1C(=O)NCc1ccnc(-c2ccco2)c1
466198,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21,310.11862,[M+H]+,20.0,val,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21
466199,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21,310.11862,[M+H]+,20.0,val,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21
466200,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21,310.11862,[M+H]+,60.0,val,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21
466201,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21,310.11862,[M+H]+,30.0,val,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21
466202,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21,310.11862,[M+H]+,20.0,val,O=C1CC2(CCN(C(=O)c3cnccn3)C2)Oc2ccccc21
466203,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466204,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466205,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,310.11862,[M+H]+,45.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466206,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,310.11862,[M+H]+,60.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466207,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1,310.11862,[M+H]+,20.0,val,COc1ccc(-c2cc(CNC(=O)c3ccncc3)no2)cc1
466208,Cc1cc(C(=O)O)cc(NS(=O)(=O)c2cn(-c3ccccc3)nc2)c1,356.07105,[M-H]-,20.0,val,Cc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1
466209,Cc1cc(C(=O)O)cc(NS(=O)(=O)c2cn(-c3ccccc3)nc2)c1,356.07105,[M-H]-,20.0,val,Cc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1
466210,Cc1cc(C(=O)O)cc(NS(=O)(=O)c2cn(-c3ccccc3)nc2)c1,356.07105,[M-H]-,60.0,val,Cc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1
466211,Cc1cc(C(=O)O)cc(NS(=O)(=O)c2cn(-c3ccccc3)nc2)c1,356.07105,[M-H]-,30.0,val,Cc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1
466212,Cc1cc(C(=O)O)cc(NS(=O)(=O)c2cn(-c3ccccc3)nc2)c1,356.07105,[M-H]-,20.0,val,Cc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1
466213,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466214,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466215,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,60.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466216,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,30.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466217,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466218,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,60.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466219,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,30.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466220,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,356.07105,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466221,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,358.0856,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466222,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,358.0856,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466223,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,358.0856,[M+H]+,60.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466224,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,358.0856,[M+H]+,15.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466225,COC(=O)c1ccccc1NC(=O)CSc1c(C#N)c(C)cc(=O)[nH]1,358.0856,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(C)c1C#N
466226,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466227,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466228,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466229,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,30.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466230,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466231,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466232,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,30.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466233,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,312.06999,[M-H]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466234,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,358.07547,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466235,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,358.07547,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466236,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,358.07547,[M+FA]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466237,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,358.07547,[M+FA]-,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466238,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,358.07547,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466239,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,312.06999,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466240,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,312.06999,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466241,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,312.06999,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466242,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,312.06999,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466243,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,312.06999,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466244,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466245,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466246,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,30.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466247,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466248,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466249,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466250,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466251,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1,296.07398,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)cc1)c1cccs1
466252,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466253,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466254,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466255,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,30.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466256,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466257,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466258,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,30.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466259,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1,314.08454,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3sccc3c2)c1
466260,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12,314.08454,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12
466261,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12,314.08454,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12
466262,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12,314.08454,[M+H]+,60.0,val,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12
466263,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12,314.08454,[M+H]+,30.0,val,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12
466264,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12,314.08454,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccccc3SC)oc12
466265,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,312.08775,[M-H]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466266,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,312.08775,[M-H]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466267,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,312.08775,[M-H]-,60.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466268,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,312.08775,[M-H]-,15.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466269,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,312.08775,[M-H]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466270,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,348.06442,[M+Cl]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466271,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,348.06442,[M+Cl]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466272,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,348.06442,[M+Cl]-,60.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466273,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,358.09323,[M+FA]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466274,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,358.09323,[M+FA]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466275,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,358.09323,[M+FA]-,60.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466276,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,358.09323,[M+FA]-,15.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466277,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,358.09323,[M+FA]-,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466278,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466279,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466280,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,314.1023,[M+H]+,60.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466281,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,314.1023,[M+H]+,15.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466282,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC2(C)OC(=O)c3ccccc3O2)cc1
466283,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466284,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466285,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,60.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466286,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,15.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466287,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466288,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466289,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466290,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,60.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466291,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,15.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466292,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1,314.1023,[M+H]+,20.0,val,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
466293,CC(=O)OCCc1c(C)c2c(oc1=O)c1ccccc1[nH]c2=O,312.08775,[M-H]-,20.0,val,CC(=O)OCCc1c(C)c2c(=O)[nH]c3ccccc3c2oc1=O
466294,CC(=O)OCCc1c(C)c2c(oc1=O)c1ccccc1[nH]c2=O,312.08775,[M-H]-,20.0,val,CC(=O)OCCc1c(C)c2c(=O)[nH]c3ccccc3c2oc1=O
466295,CC(=O)OCCc1c(C)c2c(oc1=O)c1ccccc1[nH]c2=O,312.08775,[M-H]-,30.0,val,CC(=O)OCCc1c(C)c2c(=O)[nH]c3ccccc3c2oc1=O
466296,CC(=O)OCCc1c(C)c2c(oc1=O)c1ccccc1[nH]c2=O,312.08775,[M-H]-,20.0,val,CC(=O)OCCc1c(C)c2c(=O)[nH]c3ccccc3c2oc1=O
466297,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2,312.08775,[M-H]-,20.0,val,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2
466298,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2,312.08775,[M-H]-,20.0,val,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2
466299,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2,312.08775,[M-H]-,60.0,val,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2
466300,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2,312.08775,[M-H]-,30.0,val,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2
466301,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2,312.08775,[M-H]-,20.0,val,Cc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2
466302,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466303,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466304,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466305,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466306,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466307,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466308,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466309,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,312.08775,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466310,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466311,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466312,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466313,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466314,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466315,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466316,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466317,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,348.06442,[M+Cl]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466318,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466319,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466320,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,60.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466321,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,30.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466322,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466323,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,30.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466324,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466325,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,312.08775,[M-H]-,60.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466326,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,358.09323,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466327,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,358.09323,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466328,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,358.09323,[M+FA]-,60.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466329,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,358.09323,[M+FA]-,15.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466330,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,358.09323,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466331,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2,314.1023,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2
466332,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2,314.1023,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2
466333,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2,314.1023,[M+H]+,60.0,val,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2
466334,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2,314.1023,[M+H]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2
466335,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2,314.1023,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCO2
466336,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C,314.1023,[M+H]+,20.0,val,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C
466337,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C,314.1023,[M+H]+,20.0,val,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C
466338,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C,314.1023,[M+H]+,60.0,val,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C
466339,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C,314.1023,[M+H]+,30.0,val,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C
466340,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C,314.1023,[M+H]+,20.0,val,CCOC(=O)c1oc2ccc(NC(=O)c3ccco3)cc2c1C
466341,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,314.1023,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466342,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,314.1023,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466343,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,314.1023,[M+H]+,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466344,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,314.1023,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466345,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1,314.1023,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)COC3=O)c1
466346,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,296.09174,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466347,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,296.09174,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466348,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,296.09174,[M+H-H2O]+,60.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466349,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,296.09174,[M+H-H2O]+,15.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466350,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,296.09174,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466351,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,314.1023,[M+H]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466352,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,314.1023,[M+H]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466353,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,314.1023,[M+H]+,60.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466354,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,314.1023,[M+H]+,15.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466355,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1,314.1023,[M+H]+,20.0,val,O=C(NCCC(O)c1ccco1)c1cc(=O)c2ccccc2o1
466356,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,394.0699,[M+FA]-,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466357,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,394.0699,[M+FA]-,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466358,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,394.0699,[M+FA]-,60.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466359,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,394.0699,[M+FA]-,15.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466360,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,394.0699,[M+FA]-,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466361,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,350.07898,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466362,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,350.07898,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466363,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,350.07898,[M+H]+,60.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466364,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,350.07898,[M+H]+,30.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466365,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1,350.07898,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1
466366,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466367,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466368,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,60.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466369,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,30.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466370,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466371,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,60.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466372,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,30.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466373,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,396.03141,[M-H]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466374,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,432.00809,[M+Cl]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466375,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,432.00809,[M+Cl]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466376,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,432.00809,[M+Cl]-,60.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466377,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,432.00809,[M+Cl]-,15.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466378,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,432.00809,[M+Cl]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466379,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,442.03689,[M+FA]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466380,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,442.03689,[M+FA]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466381,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,442.03689,[M+FA]-,60.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466382,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,442.03689,[M+FA]-,15.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466383,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,442.03689,[M+FA]-,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466384,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,398.04596,[M+H]+,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466385,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,398.04596,[M+H]+,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466386,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,398.04596,[M+H]+,60.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466387,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,398.04596,[M+H]+,15.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466388,COc1c(Cl)cc2c(C)c(CC(=O)NC3C=CS(=O)(=O)C3)c(=O)oc2c1,398.04596,[M+H]+,20.0,val,COc1cc2oc(=O)c(CC(=O)NC3C=CS(=O)(=O)C3)c(C)c2cc1Cl
466389,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466390,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466391,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,60.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466392,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,15.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466393,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466394,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466395,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466396,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466397,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,30.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466398,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466399,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466400,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,30.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466401,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,322.10604,[M-H]-,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466402,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,358.08271,[M+Cl]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466403,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,358.08271,[M+Cl]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466404,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,358.08271,[M+Cl]-,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466405,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,358.08271,[M+Cl]-,15.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466406,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,358.08271,[M+Cl]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466407,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466408,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466409,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466410,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,15.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466411,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,368.11152,[M+FA]-,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466412,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466413,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466414,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,15.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466415,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466416,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,30.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466417,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466418,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,60.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466419,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(NCC(O)Cc1ccccc1)c1cccc(C(F)(F)F)c1
466420,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466421,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466422,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,60.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466423,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,30.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466424,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466425,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,20.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466426,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,30.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466427,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1,324.12059,[M+H]+,60.0,val,O=C(Cc1ccccc1)NCCOc1cccc(C(F)(F)F)c1
466428,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466429,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466430,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,60.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466431,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,30.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466432,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466433,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,60.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466434,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,30.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466435,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,344.10521,[M-H]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466436,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,380.08188,[M+Cl]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466437,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,380.08188,[M+Cl]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466438,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,380.08188,[M+Cl]-,60.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466439,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,380.08188,[M+Cl]-,15.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466440,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,380.08188,[M+Cl]-,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466441,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,346.11976,[M+H]+,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466442,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,346.11976,[M+H]+,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466443,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,346.11976,[M+H]+,30.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466444,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,346.11976,[M+H]+,60.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466445,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1,346.11976,[M+H]+,20.0,val,O=C1CCC(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)C(=O)N1
466446,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466447,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466448,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,60.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466449,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,30.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466450,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466451,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,30.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466452,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,60.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466453,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,340.12153,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466454,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466455,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466456,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466457,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466458,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466459,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466460,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466461,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1,342.13608,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)N1CCc2nc3cc[nH]n3c(=O)c2C1
466462,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1,342.13608,[M+H]+,20.0,val,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1
466463,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1,342.13608,[M+H]+,20.0,val,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1
466464,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1,342.13608,[M+H]+,60.0,val,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1
466465,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1,342.13608,[M+H]+,15.0,val,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1
466466,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1,342.13608,[M+H]+,20.0,val,Cc1ccc(-n2nnc(C(=O)NCCOc3ccc(F)cc3)n2)cc1
466467,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466468,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466469,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,45.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466470,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,60.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466471,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466472,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,45.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466473,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466474,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,323.11769,[M-H2O]+,60.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466475,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,342.13608,[M+H]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466476,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,342.13608,[M+H]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466477,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,342.13608,[M+H]+,60.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466478,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,342.13608,[M+H]+,30.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466479,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1,342.13608,[M+H]+,20.0,val,CN(C(=O)COc1ccc(F)cc1)C1CN(c2nccnc2C#N)C1
466480,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,424.06519,[M+Cl]-,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466481,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,424.06519,[M+Cl]-,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466482,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,424.06519,[M+Cl]-,60.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466483,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,424.06519,[M+Cl]-,30.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466484,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,424.06519,[M+Cl]-,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466485,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,390.10307,[M+H]+,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466486,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,390.10307,[M+H]+,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466487,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,390.10307,[M+H]+,60.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466488,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,390.10307,[M+H]+,15.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466489,Cc1c(C)c(C(=O)NCc2cc(F)cc3c2OCOC3)c(-n2cnnn2)s1,390.10307,[M+H]+,20.0,val,Cc1sc(-n2cnnn2)c(C(=O)NCc2cc(F)cc3c2OCOC3)c1C
466490,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466491,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466492,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,60.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466493,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466494,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,45.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466495,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,60.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466496,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466497,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,327.08089,[M-H]-,45.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466498,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466499,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466500,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,60.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466501,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466502,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,45.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466503,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,60.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466504,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,20.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466505,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1,329.09544,[M+H]+,45.0,val,Cc1ncc(-c2ccc(NS(=O)(=O)c3ccccc3C)cc2)o1
466506,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,327.08089,[M-H]-,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466507,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,327.08089,[M-H]-,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466508,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,327.08089,[M-H]-,45.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466509,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,327.08089,[M-H]-,60.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466510,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,327.08089,[M-H]-,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466511,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,327.08089,[M-H]-,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466512,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,327.08089,[M-H]-,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466513,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,327.08089,[M-H]-,60.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466514,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,327.08089,[M-H]-,30.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466515,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,327.08089,[M-H]-,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466516,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466517,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466518,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,45.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466519,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,60.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466520,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466521,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,45.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466522,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466523,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,327.08089,[M-H]-,60.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466524,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466525,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466526,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466527,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466528,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466529,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466530,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466531,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1,327.08089,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(-n3cccc3)cc2)cc1
466532,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466533,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466534,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,45.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466535,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,60.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466536,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466537,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466538,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,45.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466539,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,327.08089,[M-H]-,60.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466540,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,327.08089,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466541,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,327.08089,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466542,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,327.08089,[M-H]-,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466543,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,327.08089,[M-H]-,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466544,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,327.08089,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466545,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1,327.08089,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1
466546,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1,327.08089,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1
466547,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1,327.08089,[M-H]-,60.0,val,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1
466548,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1,327.08089,[M-H]-,30.0,val,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1
466549,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1,327.08089,[M-H]-,20.0,val,O=C1CCc2cc(S(=O)(=O)N3CCc4ccccc43)ccc2N1
466550,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,327.08089,[M-H]-,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466551,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,327.08089,[M-H]-,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466552,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,327.08089,[M-H]-,60.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466553,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,327.08089,[M-H]-,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466554,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,327.08089,[M-H]-,60.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466555,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,363.05756,[M+Cl]-,20.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466556,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,363.05756,[M+Cl]-,15.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466557,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,327.08089,[M-H]-,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466558,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,327.08089,[M-H]-,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466559,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,327.08089,[M-H]-,60.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466560,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,327.08089,[M-H]-,30.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466561,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,327.08089,[M-H]-,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466562,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC,329.09544,[M+H]+,20.0,val,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC
466563,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC,329.09544,[M+H]+,20.0,val,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC
466564,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC,329.09544,[M+H]+,60.0,val,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC
466565,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC,329.09544,[M+H]+,30.0,val,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC
466566,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC,329.09544,[M+H]+,20.0,val,COc1ccc(-c2noc(CSc3ccccc3)n2)cc1OC
466567,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466568,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466569,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,329.09544,[M+H]+,45.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466570,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,329.09544,[M+H]+,60.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466571,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc2nc(Cc3ccccc3)[nH]c(=O)c2c1C
466572,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,20.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466573,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,20.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466574,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,45.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466575,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,60.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466576,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,20.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466577,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,60.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466578,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,45.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466579,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1,329.09544,[M+H]+,20.0,val,COc1cccc(C(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1
466580,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466581,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466582,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,30.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466583,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,60.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466584,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,15.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466585,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466586,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466587,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1,329.09544,[M+H]+,60.0,val,Cc1cc(C)c(C(=O)CSc2nnc(-c3ccco3)o2)c(C)c1
466588,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466589,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466590,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,60.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466591,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,30.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466592,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466593,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466594,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,30.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466595,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,329.09544,[M+H]+,60.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466596,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466597,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466598,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,60.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466599,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,30.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466600,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466601,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,20.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466602,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,30.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466603,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12,351.07738,[M+Na]+,60.0,val,COc1cccc2sc(N(Cc3ccco3)C(=O)C3CC3)nc12
466604,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466605,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466606,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466607,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466608,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466609,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466610,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466611,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1,329.09544,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1
466612,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,20.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466613,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,20.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466614,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,60.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466615,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,30.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466616,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,20.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466617,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,20.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466618,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,60.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466619,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1,329.09544,[M+H]+,30.0,val,c1coc(Cn2ccnc2SCC2COc3ccccc3O2)c1
466620,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466621,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466622,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466623,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466624,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466625,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466626,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466627,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1,329.09544,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1
466628,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466629,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466630,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,60.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466631,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,15.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466632,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466633,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,60.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466634,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466635,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1,329.09544,[M+H]+,15.0,val,COc1ccc(-c2cc(CC(=O)NCc3cccs3)no2)cc1
466636,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1,329.09544,[M+H]+,20.0,val,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1
466637,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1,329.09544,[M+H]+,20.0,val,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1
466638,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1,329.09544,[M+H]+,45.0,val,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1
466639,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1,329.09544,[M+H]+,60.0,val,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1
466640,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1,329.09544,[M+H]+,20.0,val,CCOC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1
466641,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466642,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466643,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466644,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466645,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466646,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466647,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466648,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12,329.09544,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)NCc2ccccn2)c2ccccc12
466649,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,329.09544,[M+H]+,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466650,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,329.09544,[M+H]+,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466651,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,329.09544,[M+H]+,60.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466652,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,329.09544,[M+H]+,30.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466653,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21,329.09544,[M+H]+,20.0,val,O=C1OC2(CCN(C(=O)Nc3cccs3)CC2)c2ccccc21
466654,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,329.09544,[M+H]+,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466655,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,329.09544,[M+H]+,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466656,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,329.09544,[M+H]+,60.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466657,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,329.09544,[M+H]+,15.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466658,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O,329.09544,[M+H]+,20.0,val,COc1ccccc1NC(=O)CC1Sc2ccccc2NC1=O
466659,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466660,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466661,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,45.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466662,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,60.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466663,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466664,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,60.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466665,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,45.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466666,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1,329.09544,[M+H]+,20.0,val,Cc1ccc2nc(NC(=O)C3C4CC5OC(=O)C3C5C4)sc2c1
466667,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1
466668,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1
466669,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1,329.09544,[M+H]+,60.0,val,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1
466670,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1,329.09544,[M+H]+,15.0,val,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1
466671,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,COc1ccccc1CNC(=O)Cc1cc(-c2cccs2)on1
466672,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1,329.09544,[M+H]+,20.0,val,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1
466673,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1,329.09544,[M+H]+,20.0,val,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1
466674,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1,329.09544,[M+H]+,60.0,val,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1
466675,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1,329.09544,[M+H]+,15.0,val,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1
466676,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1,329.09544,[M+H]+,20.0,val,O=C(NCC(c1ccco1)c1cccs1)c1cc(C2CC2)on1
466677,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,20.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466678,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,20.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466679,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,60.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466680,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,30.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466681,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,20.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466682,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,60.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466683,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,20.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466684,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1,329.09544,[M+H]+,30.0,val,O=C(c1cc(-c2ccco2)on1)N1CCC(c2cccs2)CC1
466685,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12
466686,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12
466687,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12,329.09544,[M+H]+,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12
466688,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12,329.09544,[M+H]+,30.0,val,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12
466689,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12,329.09544,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(Cc3ccccc3)cnc12
466690,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,329.09544,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466691,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,329.09544,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466692,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,329.09544,[M+H]+,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466693,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,329.09544,[M+H]+,15.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466694,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1,329.09544,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCC1(c2ccsc2)CC1
466695,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,311.08488,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466696,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,311.08488,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466697,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,311.08488,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466698,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,311.08488,[M+H-H2O]+,30.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466699,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1,311.08488,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)c1csc(-c2ccccc2)n1)c1ccco1
466700,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466701,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466702,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466703,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466704,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466705,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466706,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466707,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1,329.09544,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCc1cc(-c2cccs2)on1
466708,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,329.09544,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466709,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,329.09544,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466710,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,329.09544,[M+H]+,45.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466711,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,329.09544,[M+H]+,60.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466712,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1,329.09544,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)Nc3ccncc3)ccc2c1
466713,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1
466714,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1
466715,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1,329.09544,[M+H]+,15.0,val,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1
466716,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1,329.09544,[M+H]+,60.0,val,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1
466717,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1,329.09544,[M+H]+,20.0,val,COc1ccc(CC(=O)NCc2cc(-c3cccs3)on2)cc1
466718,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466719,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466720,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,60.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466721,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,30.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466722,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466723,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,30.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466724,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,20.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466725,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O,329.09544,[M+H]+,60.0,val,O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccccc1O
466726,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,311.10373,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466727,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,311.10373,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466728,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,311.10373,[M-H]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466729,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,311.10373,[M-H]-,30.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466730,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,311.10373,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466731,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,357.10921,[M+FA]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466732,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,357.10921,[M+FA]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466733,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,357.10921,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466734,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,357.10921,[M+FA]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466735,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,357.10921,[M+FA]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466736,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,313.11828,[M+H]+,30.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466737,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,313.11828,[M+H]+,30.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466738,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,313.11828,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466739,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,313.11828,[M+H]+,60.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466740,COc1cc2c(cc1)[nH]cc2CCNC(=O)c1cc(=O)cco1,313.11828,[M+H]+,30.0,val,COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)cco3)c2c1
466741,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,311.10373,[M-H]-,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466742,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,311.10373,[M-H]-,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466743,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,311.10373,[M-H]-,60.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466744,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,311.10373,[M-H]-,30.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466745,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,311.10373,[M-H]-,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466746,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466747,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466748,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,313.11828,[M+H]+,60.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466749,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,313.11828,[M+H]+,30.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466750,COc1c(C)cccc1C(=O)Nc1cc2c(cc1)OCC(=O)N2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466751,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,311.10373,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466752,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,311.10373,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466753,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,311.10373,[M-H]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466754,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,311.10373,[M-H]-,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466755,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,311.10373,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466756,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,347.08041,[M+Cl]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466757,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,347.08041,[M+Cl]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466758,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,347.08041,[M+Cl]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466759,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,347.08041,[M+Cl]-,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466760,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,347.08041,[M+Cl]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466761,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,357.10921,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466762,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,357.10921,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466763,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,357.10921,[M+FA]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466764,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,357.10921,[M+FA]-,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466765,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,357.10921,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466766,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,357.10921,[M+FA]-,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466767,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,357.10921,[M+FA]-,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466768,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,357.10921,[M+FA]-,60.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466769,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,357.10921,[M+FA]-,15.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466770,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,357.10921,[M+FA]-,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466771,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,311.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466772,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,311.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466773,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,311.10373,[M-H]-,60.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466774,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,311.10373,[M-H]-,30.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466775,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,311.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466776,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,347.08041,[M+Cl]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466777,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,347.08041,[M+Cl]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466778,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,347.08041,[M+Cl]-,60.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466779,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,347.08041,[M+Cl]-,15.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466780,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,347.08041,[M+Cl]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466781,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,357.10921,[M+FA]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466782,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,357.10921,[M+FA]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466783,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,357.10921,[M+FA]-,60.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466784,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,357.10921,[M+FA]-,15.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466785,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,357.10921,[M+FA]-,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466786,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466787,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466788,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,45.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466789,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,60.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466790,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466791,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466792,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,45.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466793,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,311.10373,[M-H]-,60.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466794,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,357.10921,[M+FA]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466795,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,357.10921,[M+FA]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466796,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,357.10921,[M+FA]-,60.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466797,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,357.10921,[M+FA]-,15.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466798,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,357.10921,[M+FA]-,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466799,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466800,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466801,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,60.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466802,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,30.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466803,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466804,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,30.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466805,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,60.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466806,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1,313.11828,[M+H]+,20.0,val,COC(=O)c1ccc(C(=O)N2CC(Oc3cccnc3)C2)cc1
466807,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,313.11828,[M+H]+,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466808,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,313.11828,[M+H]+,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466809,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,313.11828,[M+H]+,60.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466810,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,313.11828,[M+H]+,30.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466811,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1,313.11828,[M+H]+,20.0,val,O=C(Nc1ccccc1)OCC1CN(c2ccccc2)C(=O)O1
466812,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,312.11101,[M]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466813,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,312.11101,[M]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466814,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,312.11101,[M]+,60.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466815,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,312.11101,[M]+,30.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466816,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,312.11101,[M]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466817,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,313.11828,[M+H]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466818,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,313.11828,[M+H]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466819,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,313.11828,[M+H]+,45.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466820,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,313.11828,[M+H]+,60.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466821,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12,313.11828,[M+H]+,20.0,val,CCOC(=O)c1c2ccc(OCC(N)=O)cc2n2ccccc12
466822,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,295.10772,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466823,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,295.10772,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466824,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,295.10772,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466825,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,295.10772,[M+H-H2O]+,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466826,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1,295.10772,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)Nc1ccccc1
466827,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466828,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466829,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,45.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466830,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,60.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466831,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466832,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,45.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466833,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,20.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466834,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC,313.11828,[M+H]+,60.0,val,COc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1OC
466835,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1,313.11828,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1
466836,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1,313.11828,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1
466837,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1,313.11828,[M+H]+,60.0,val,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1
466838,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1,313.11828,[M+H]+,30.0,val,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1
466839,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1,313.11828,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cc2noc3ccccc23)c1
466840,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,20.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466841,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,20.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466842,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,60.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466843,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,30.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466844,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,20.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466845,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,30.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466846,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,60.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466847,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1,313.11828,[M+H]+,20.0,val,O=C(c1cccc2c1OCCO2)N1CC(Oc2ccncc2)C1
466848,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466849,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466850,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2,313.11828,[M+H]+,60.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466851,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2,313.11828,[M+H]+,30.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466852,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2,313.11828,[M+H]+,20.0,val,COc1c(C)cccc1C(=O)Nc1ccc2c(c1)NC(=O)CO2
466853,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466854,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466855,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,60.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466856,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,30.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466857,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466858,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466859,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,60.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466860,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1,313.11828,[M+H]+,30.0,val,Cc1ccccc1OCC(=O)NCc1cc(-c2ccco2)on1
466861,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466862,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466863,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,307.12005,[M-H]-,60.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466864,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466865,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,307.12005,[M-H]-,45.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466866,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466867,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466868,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,60.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466869,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466870,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,45.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466871,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,60.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466872,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466873,CC(=O)Nc1ccc(NC(=O)c2c3c(ccc2)ncn3C)cc1,309.1346,[M+H]+,45.0,val,CC(=O)Nc1ccc(NC(=O)c2cccc3ncn(C)c23)cc1
466874,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O,309.1346,[M+H]+,20.0,val,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O
466875,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O,309.1346,[M+H]+,20.0,val,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O
466876,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O,309.1346,[M+H]+,60.0,val,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O
466877,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O,309.1346,[M+H]+,30.0,val,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O
466878,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O,309.1346,[M+H]+,20.0,val,COCC#CCn1cnc2c(cnn2-c2ccc(C)cc2)c1=O
466879,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466880,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466881,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,60.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466882,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,30.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466883,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466884,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,291.12404,[M+H-H2O]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466885,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,291.12404,[M+H-H2O]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466886,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,291.12404,[M+H-H2O]+,60.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466887,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,291.12404,[M+H-H2O]+,30.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466888,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,291.12404,[M+H-H2O]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466889,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466890,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466891,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,60.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466892,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,30.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466893,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466894,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,60.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466895,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,30.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466896,Cc1c(NC(=O)c2cnccc2)c(=O)n(-c2ccccc2)n1C,309.1346,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C
466897,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466898,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466899,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,60.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466900,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466901,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,45.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466902,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,60.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466903,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466904,Cc1cc2c(cc1C)n(CCc1noc(-c3ccco3)n1)cn2,309.1346,[M+H]+,45.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
466905,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466906,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466907,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,30.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466908,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466909,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466910,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,45.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466911,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466912,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,307.12005,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
466913,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,307.12005,[M-H]-,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
466914,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,307.12005,[M-H]-,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
466915,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,307.12005,[M-H]-,60.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
466916,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,307.12005,[M-H]-,30.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
466917,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,307.12005,[M-H]-,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
466918,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466919,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466920,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,45.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466921,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466922,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466923,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,45.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466924,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466925,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,307.12005,[M-H]-,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
466926,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,307.12005,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
466927,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,307.12005,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
466928,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,307.12005,[M-H]-,45.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
466929,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,307.12005,[M-H]-,60.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
466930,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,307.12005,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
466931,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466932,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466933,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,60.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466934,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,30.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466935,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466936,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,30.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466937,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,60.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466938,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,307.12005,[M-H]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466939,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,343.09673,[M+Cl]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466940,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,343.09673,[M+Cl]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466941,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,343.09673,[M+Cl]-,15.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466942,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,353.12553,[M+FA]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466943,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,353.12553,[M+FA]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466944,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,353.12553,[M+FA]-,60.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466945,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,353.12553,[M+FA]-,15.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466946,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,353.12553,[M+FA]-,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
466947,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466948,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466949,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,45.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466950,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,60.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466951,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466952,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,45.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466953,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,60.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466954,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,307.12005,[M-H]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466955,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,353.12553,[M+FA]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466956,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,353.12553,[M+FA]-,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466957,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,353.12553,[M+FA]-,60.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
466958,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466959,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466960,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466961,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,30.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466962,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466963,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,30.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466964,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466965,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,307.12005,[M-H]-,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466966,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,343.09673,[M+Cl]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466967,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,343.09673,[M+Cl]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466968,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,343.09673,[M+Cl]-,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466969,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,343.09673,[M+Cl]-,30.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466970,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,343.09673,[M+Cl]-,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466971,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,353.12553,[M+FA]-,45.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466972,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,353.12553,[M+FA]-,45.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466973,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,353.12553,[M+FA]-,45.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466974,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,353.12553,[M+FA]-,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
466975,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466976,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466977,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,45.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466978,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,60.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466979,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466980,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,45.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466981,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,60.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466982,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,307.12005,[M-H]-,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
466983,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466984,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466985,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466986,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,30.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466987,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466988,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466989,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,30.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466990,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,307.12005,[M-H]-,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466991,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,343.09673,[M+Cl]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466992,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,343.09673,[M+Cl]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466993,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,343.09673,[M+Cl]-,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466994,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,343.09673,[M+Cl]-,15.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466995,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,343.09673,[M+Cl]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466996,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,353.12553,[M+FA]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466997,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,353.12553,[M+FA]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466998,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,353.12553,[M+FA]-,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
466999,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,353.12553,[M+FA]-,15.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467000,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,353.12553,[M+FA]-,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467001,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,291.12404,[M+H-H2O]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467002,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,291.12404,[M+H-H2O]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467003,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,291.12404,[M+H-H2O]+,45.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467004,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,291.12404,[M+H-H2O]+,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467005,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,291.12404,[M+H-H2O]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467006,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467007,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467008,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,30.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467009,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467010,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,15.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467011,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467012,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,60.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467013,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2,309.1346,[M+H]+,20.0,val,OC(CNc1ncnc2ncccc12)c1ccc2c(c1)CCO2
467014,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,309.1346,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
467015,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,309.1346,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
467016,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,309.1346,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
467017,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,309.1346,[M+H]+,30.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
467018,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1,309.1346,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)Nc2cc(-c3cccnc3)no2)c1
467019,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467020,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467021,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,60.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467022,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,30.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467023,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467024,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,30.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467025,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,60.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467026,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1,309.1346,[M+H]+,20.0,val,COc1ccccc1NC(=O)Cn1cc(-c2ccccc2)nn1
467027,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467028,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467029,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,60.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467030,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,30.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467031,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467032,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467033,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,30.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467034,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1,309.1346,[M+H]+,60.0,val,COc1ccc(-c2cc(C(=O)Nc3ccccn3)n(C)n2)cc1
467035,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467036,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467037,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,60.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467038,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,30.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467039,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467040,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,30.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467041,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,20.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467042,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2,309.1346,[M+H]+,60.0,val,O=C(NCCn1cccc1)c1[nH]nc2c1COc1ccccc1-2
467043,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467044,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467045,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467046,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,30.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467047,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467048,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,30.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467049,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467050,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1,309.1346,[M+H]+,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccncc1
467051,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,20.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467052,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,20.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467053,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,30.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467054,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,60.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467055,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,15.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467056,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,20.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467057,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,20.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467058,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1,309.1346,[M+H]+,60.0,val,O=C(NCCn1ncccc1=O)c1ccc(-n2cccc2)cc1
467059,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467060,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467061,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467062,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467063,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467064,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1,309.1346,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(O)cc3)cn2)n1
467065,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467066,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467067,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,60.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467068,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,30.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467069,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467070,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,30.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467071,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,60.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467072,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1,309.1346,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2cccn3nc(C4CC4)nc23)cc1
467073,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467074,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467075,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,60.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467076,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,30.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467077,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467078,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,30.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467079,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,60.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467080,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1,309.1346,[M+H]+,20.0,val,O=C(NCCCn1cnc2ccccc2c1=O)c1ccncc1
467081,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467082,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467083,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,30.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467084,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,60.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467085,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,15.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467086,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467087,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,60.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467088,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1,309.1346,[M+H]+,20.0,val,Cn1nccc1C(=O)NCc1cccnc1Oc1ccccc1
467089,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467090,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467091,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,45.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467092,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,60.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467093,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467094,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,45.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467095,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,60.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467096,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1,309.1346,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CC(Cn2ccnc2)C1
467097,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467098,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467099,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,45.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467100,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467101,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467102,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,45.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467103,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,60.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467104,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21,309.1346,[M+H]+,20.0,val,NC(=O)Cn1c(CNC(=O)c2ccccc2)nc2ccccc21
467105,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467106,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467107,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,45.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467108,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,60.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467109,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467110,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,60.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467111,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,45.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467112,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C,309.1346,[M+H]+,20.0,val,Cc1cc2ncn(CCc3noc(-c4ccco4)n3)c2cc1C
467113,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,20.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467114,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,20.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467115,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,30.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467116,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,60.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467117,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,15.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467118,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,20.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467119,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,60.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467120,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1,309.1346,[M+H]+,20.0,val,COc1cc2ccccc2cc1C(=O)N1CC(n2nccn2)C1
467121,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467122,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467123,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,60.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467124,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467125,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,60.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467126,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1,309.1346,[M+H]+,20.0,val,CC(=O)Nc1cc(NC(C)=O)cc(-c2nc3ccccc3[nH]2)c1
467127,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,20.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467128,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,20.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467129,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,45.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467130,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,60.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467131,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,20.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467132,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,20.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467133,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,60.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467134,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1,321.14583,[M+H]+,45.0,val,O=c1ccc(-c2ccncc2)nn1CC1CN(c2ncccn2)C1
467135,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1,321.14583,[M+H]+,20.0,val,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1
467136,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1,321.14583,[M+H]+,20.0,val,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1
467137,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1,321.14583,[M+H]+,60.0,val,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1
467138,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1,321.14583,[M+H]+,15.0,val,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1
467139,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1,321.14583,[M+H]+,20.0,val,O=C(NC1CN(c2ccccn2)C1)c1cnn(-c2ccccc2)n1
467140,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,20.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467141,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,20.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467142,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,60.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467143,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,20.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467144,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,60.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467145,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1,321.14583,[M+H]+,20.0,val,c1ccc2oc(C3CCCN(c4ccc5nncn5n4)C3)nc2c1
467146,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467147,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467148,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,60.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467149,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,30.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467150,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467151,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,60.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467152,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,30.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467153,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,299.0925,[M-H]-,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467154,Cc1c(O)c(C)c2OC(c3ccc(O)cc3)CC(=O)c2c1O,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467155,Cc1c(O)c(C)c2OC(c3ccc(O)cc3)CC(=O)c2c1O,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467156,Cc1c(O)c(C)c2OC(c3ccc(O)cc3)CC(=O)c2c1O,299.0925,[M-H]-,60.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467157,Cc1c(O)c(C)c2OC(c3ccc(O)cc3)CC(=O)c2c1O,299.0925,[M-H]-,30.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467158,Cc1c(O)c(C)c2OC(c3ccc(O)cc3)CC(=O)c2c1O,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467159,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467160,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467161,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,60.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467162,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,30.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467163,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467164,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,60.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467165,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,30.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467166,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
467167,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467168,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467169,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,60.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467170,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,30.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467171,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467172,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,299.0925,[M-H]-,30.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467173,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,299.0925,[M-H]-,30.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467174,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,299.0925,[M-H]-,20.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467175,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,299.0925,[M-H]-,60.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467176,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,299.0925,[M-H]-,30.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467177,Cc1cc(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1C,299.0925,[M-H]-,20.0,val,Cc1cc(O)c(C)c2c1Oc1c(C)c(O)cc(C)c1C(=O)O2
467178,Cc1cc(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1C,299.0925,[M-H]-,20.0,val,Cc1cc(O)c(C)c2c1Oc1c(C)c(O)cc(C)c1C(=O)O2
467179,Cc1cc(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1C,299.0925,[M-H]-,60.0,val,Cc1cc(O)c(C)c2c1Oc1c(C)c(O)cc(C)c1C(=O)O2
467180,Cc1cc(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1C,299.0925,[M-H]-,30.0,val,Cc1cc(O)c(C)c2c1Oc1c(C)c(O)cc(C)c1C(=O)O2
467181,Cc1cc(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1C,299.0925,[M-H]-,20.0,val,Cc1cc(O)c(C)c2c1Oc1c(C)c(O)cc(C)c1C(=O)O2
467182,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467183,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467184,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,301.10705,[M+H]+,60.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467185,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,301.10705,[M+H]+,30.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467186,COc1c(C(=O)/C=C/c2ccccc2)c(OC)c(O)c(O)c1,301.10705,[M+H]+,20.0,val,COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c1ccccc1
467187,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467188,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467189,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,60.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467190,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467191,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,45.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467192,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,60.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467193,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,20.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467194,COc1cc2c3oc(C)cc(=O)c3c(OC)cc2c(OC)c1,301.10705,[M+H]+,45.0,val,COc1cc(OC)c2cc(OC)c3c(=O)cc(C)oc3c2c1
467195,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,301.10705,[M+H]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467196,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,301.10705,[M+H]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467197,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,301.10705,[M+H]+,60.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467198,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,301.10705,[M+H]+,15.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467199,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,301.10705,[M+H]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467200,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,318.1336,[M+NH4]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467201,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,318.1336,[M+NH4]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467202,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,318.1336,[M+NH4]+,60.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467203,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,318.1336,[M+NH4]+,15.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467204,COc1c2ccoc2c(OCC=C(C)C)c2c1ccc(=O)o2,318.1336,[M+NH4]+,20.0,val,COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12
467205,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467206,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467207,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,60.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467208,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,30.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467209,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC,283.09649,[M+H-H2O]+,20.0,val,COc1cccc(C(O)C2OC(=O)c3ccccc32)c1OC
467210,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,20.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467211,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,20.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467212,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,60.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467213,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,30.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467214,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,20.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467215,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,60.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467216,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,30.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467217,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1,301.10705,[M+H]+,20.0,val,O=C(COC(=O)C1C2CC3OC(=O)C1C3C2)c1ccccc1
467218,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467219,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467220,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,45.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467221,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,60.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467222,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467223,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,45.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467224,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,60.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467225,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2,299.0925,[M-H]-,20.0,val,Cc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(O)cc1)O2
467226,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12,301.10705,[M+H]+,20.0,val,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
467227,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12,301.10705,[M+H]+,20.0,val,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
467228,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12,301.10705,[M+H]+,60.0,val,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
467229,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12,301.10705,[M+H]+,15.0,val,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
467230,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12,301.10705,[M+H]+,20.0,val,COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
467231,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21,301.10705,[M+H]+,20.0,val,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21
467232,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21,301.10705,[M+H]+,20.0,val,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21
467233,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21,301.10705,[M+H]+,60.0,val,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21
467234,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21,301.10705,[M+H]+,30.0,val,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21
467235,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21,301.10705,[M+H]+,20.0,val,COc1ccc2c(c1OC)OC1c3ccc(O)cc3OCC21
467236,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1,301.10705,[M+H]+,20.0,val,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1
467237,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1,301.10705,[M+H]+,20.0,val,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1
467238,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1,301.10705,[M+H]+,60.0,val,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1
467239,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1,301.10705,[M+H]+,30.0,val,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1
467240,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1,301.10705,[M+H]+,20.0,val,COc1ccc([C@@H]2CC(=O)c3c(O)cc(OC)cc3O2)cc1
467241,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467242,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467243,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,317.10196,[M+H]+,60.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467244,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,317.10196,[M+H]+,15.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467245,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467246,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467247,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467248,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,334.12851,[M+NH4]+,60.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467249,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,334.12851,[M+NH4]+,15.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467250,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12
467251,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,299.0914,[M+H-H2O]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467252,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,299.0914,[M+H-H2O]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467253,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,299.0914,[M+H-H2O]+,60.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467254,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,299.0914,[M+H-H2O]+,30.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467255,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,299.0914,[M+H-H2O]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467256,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467257,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467258,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,317.10196,[M+H]+,60.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467259,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,317.10196,[M+H]+,15.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467260,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,317.10196,[M+H]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467261,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467262,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467263,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,334.12851,[M+NH4]+,60.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467264,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,334.12851,[M+NH4]+,15.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467265,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,334.12851,[M+NH4]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467266,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,339.08391,[M+Na]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467267,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,339.08391,[M+Na]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467268,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,339.08391,[M+Na]+,30.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467269,C=C(C)C(O)COc1c2ccoc2c(OC)c2c1ccc(=O)o2,339.08391,[M+Na]+,20.0,val,C=C(C)C(O)COc1c2ccoc2c(OC)c2oc(=O)ccc12
467270,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC,317.10196,[M+H]+,20.0,val,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC
467271,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC,317.10196,[M+H]+,20.0,val,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC
467272,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC,317.10196,[M+H]+,60.0,val,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC
467273,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC,317.10196,[M+H]+,30.0,val,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC
467274,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC,317.10196,[M+H]+,20.0,val,COc1ccc(C(=O)COc2ccc3c(c2)OCO3)cc1OC
467275,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O,315.08741,[M-H]-,20.0,val,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O
467276,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O,315.08741,[M-H]-,45.0,val,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O
467277,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O,315.08741,[M-H]-,60.0,val,COc1cc(O)c2c(c1)OC(c1ccc(OC)c(O)c1)CC2=O
467278,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(OC)cc(O)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
467279,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(OC)cc(O)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
467280,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(OC)cc(O)c1,331.08233,[M-H]-,60.0,val,COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
467281,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(OC)cc(O)c1,331.08233,[M-H]-,30.0,val,COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
467282,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(OC)cc(O)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
467283,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467284,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467285,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,60.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467286,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,30.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467287,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467288,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,60.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467289,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,30.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467290,COC(=O)c1c(C(=O)c2c(O)cc(C)cc2O)c(O)cc(OC)c1,331.08233,[M-H]-,20.0,val,COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O
467291,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,299.09566,[M-H]-,15.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467292,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,299.09566,[M-H]-,15.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467293,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,299.09566,[M-H]-,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467294,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,299.09566,[M-H]-,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467295,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,299.09566,[M-H]-,15.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467296,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467297,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467298,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467299,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467300,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467301,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467302,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467303,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467304,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467305,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467306,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467307,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467308,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467309,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467310,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467311,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467312,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467313,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467314,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467315,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467316,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467317,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467318,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467319,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467320,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467321,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467322,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,60.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467323,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,30.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467324,CCN=C1Nc2c(cc(Cl)cc2)C(C)(c2ccccc2)O1,301.11022,[M+H]+,20.0,val,CCN=C1Nc2ccc(Cl)cc2C(C)(c2ccccc2)O1
467325,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,299.09566,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467326,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,299.09566,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467327,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,299.09566,[M-H]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467328,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,345.10114,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467329,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,345.10114,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467330,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,345.10114,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467331,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,345.10114,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467332,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,345.10114,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467333,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467334,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467335,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,301.11022,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467336,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467337,O=C(Cc1ccc(Cl)cc1)NCc1cc(C2CC2)cnc1,301.11022,[M+H]+,45.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467338,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467339,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467340,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467341,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467342,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467343,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467344,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467345,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,345.10114,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467346,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467347,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467348,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,299.09566,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467349,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,299.09566,[M-H]-,30.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467350,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467351,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467352,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467353,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467354,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,30.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467355,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467356,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467357,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,30.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467358,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,299.09566,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467359,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,335.07234,[M+Cl]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467360,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,335.07234,[M+Cl]-,15.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467361,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,335.07234,[M+Cl]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467362,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467363,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467364,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467365,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,15.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467366,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467367,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467368,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,15.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467369,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,345.10114,[M+FA]-,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467370,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,299.09566,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467371,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,299.09566,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467372,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,299.09566,[M-H]-,45.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467373,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,299.09566,[M-H]-,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467374,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,299.09566,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467375,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467376,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467377,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467378,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,15.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467379,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467380,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,15.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467381,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467382,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)NC1CCCc2ccccc21
467383,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,20.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467384,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,20.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467385,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,45.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467386,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,60.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467387,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,20.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467388,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,45.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467389,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,60.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467390,Clc1ccc(OCCCCn2cnc3ccccc32)cc1,301.11022,[M+H]+,20.0,val,Clc1ccc(OCCCCn2cnc3ccccc32)cc1
467391,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O,301.11022,[M+H]+,20.0,val,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O
467392,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O,301.11022,[M+H]+,20.0,val,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O
467393,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O,301.11022,[M+H]+,60.0,val,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O
467394,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O,301.11022,[M+H]+,30.0,val,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O
467395,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O,301.11022,[M+H]+,20.0,val,CC1CNc2ccccc2N(Cc2ccccc2Cl)C1=O
467396,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,301.11022,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467397,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,301.11022,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467398,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,301.11022,[M+H]+,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467399,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,301.11022,[M+H]+,30.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467400,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1,301.11022,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)c(C)c1
467401,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467402,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467403,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467404,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,30.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467405,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467406,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467407,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,30.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467408,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1,301.11022,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)N1CCC(c2ccccc2)C1
467409,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467410,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467411,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,45.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467412,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467413,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467414,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467415,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,45.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467416,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1,301.11022,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)NCc1cncc(C2CC2)c1
467417,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467418,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467419,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,60.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467420,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467421,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,45.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467422,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,60.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467423,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467424,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,327.10181,[M-H]-,45.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467425,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,363.07849,[M+Cl]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467426,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,363.07849,[M+Cl]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467427,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,363.07849,[M+Cl]-,60.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467428,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,363.07849,[M+Cl]-,15.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467429,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,363.07849,[M+Cl]-,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467430,CCc1c(C(=O)NCc2nccc(C)c2)n2cc(Cl)ccc2n1,329.11636,[M+H]+,30.0,val,CCc1nc2ccc(Cl)cn2c1C(=O)NCc1cc(C)ccn1
467431,CCc1c(C(=O)NCc2nccc(C)c2)n2cc(Cl)ccc2n1,329.11636,[M+H]+,30.0,val,CCc1nc2ccc(Cl)cn2c1C(=O)NCc1cc(C)ccn1
467432,CCc1c(C(=O)NCc2nccc(C)c2)n2cc(Cl)ccc2n1,329.11636,[M+H]+,60.0,val,CCc1nc2ccc(Cl)cn2c1C(=O)NCc1cc(C)ccn1
467433,CCc1c(C(=O)NCc2nccc(C)c2)n2cc(Cl)ccc2n1,329.11636,[M+H]+,20.0,val,CCc1nc2ccc(Cl)cn2c1C(=O)NCc1cc(C)ccn1
467434,CCc1c(C(=O)NCc2nccc(C)c2)n2cc(Cl)ccc2n1,329.11636,[M+H]+,30.0,val,CCc1nc2ccc(Cl)cn2c1C(=O)NCc1cc(C)ccn1
467435,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467436,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467437,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,60.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467438,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,30.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467439,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467440,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,60.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467441,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,30.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467442,O=C(c1cc2c(ccc(Cl)c2)[nH]1)N1CCCCC1c1ncc[nH]1,329.11636,[M+H]+,20.0,val,O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCCCC1c1ncc[nH]1
467443,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467444,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467445,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,60.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467446,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,30.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467447,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467448,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467449,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467450,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,45.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467451,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,60.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467452,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467453,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467454,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,45.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467455,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,327.10181,[M-H]-,60.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467456,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,363.07849,[M+Cl]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467457,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,363.07849,[M+Cl]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467458,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,363.07849,[M+Cl]-,60.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467459,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,363.07849,[M+Cl]-,15.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467460,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,363.07849,[M+Cl]-,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467461,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1,329.11636,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1
467462,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1,329.11636,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1
467463,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1,329.11636,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1
467464,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1,329.11636,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1
467465,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1,329.11636,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2ncc(C#N)cc2Cl)CC1
467466,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl,329.11636,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
467467,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl,329.11636,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
467468,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl,329.11636,[M+H]+,45.0,val,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
467469,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl,329.11636,[M+H]+,60.0,val,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
467470,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl,329.11636,[M+H]+,20.0,val,CC(C)(C)C(=O)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
467471,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467472,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467473,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,60.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467474,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,30.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467475,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467476,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,60.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467477,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,30.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467478,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1,329.11636,[M+H]+,20.0,val,COC(C)(CNc1ncnc2cnccc12)c1cccc(Cl)c1
467479,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467480,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467481,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,60.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467482,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,30.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467483,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21,329.11636,[M+H]+,20.0,val,CN1C(=O)c2ccccc2N(C2CCCC2)c2nc(Cl)ncc21
467484,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl,329.11636,[M+H]+,20.0,val,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl
467485,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl,329.11636,[M+H]+,20.0,val,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl
467486,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl,329.11636,[M+H]+,45.0,val,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl
467487,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl,329.11636,[M+H]+,60.0,val,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl
467488,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl,329.11636,[M+H]+,20.0,val,Cc1nc(N2CC(COc3cccnc3)C2)c(C#N)c(C)c1Cl
467489,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,20.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467490,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,20.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467491,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,45.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467492,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,60.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467493,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,20.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467494,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,45.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467495,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,60.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467496,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1,329.11636,[M+H]+,20.0,val,N#Cc1cccc(CN2CCC(Oc3ncc(Cl)cn3)CC2)c1
467497,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1,386.06907,[M+H]+,20.0,val,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1
467498,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1,386.06907,[M+H]+,20.0,val,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1
467499,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1,386.06907,[M+H]+,60.0,val,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1
467500,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1,386.06907,[M+H]+,30.0,val,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1
467501,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1,386.06907,[M+H]+,20.0,val,O=C(c1ccccc1S(=O)(=O)C(F)F)N(CCc1cccs1)C1CC1
467502,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,311.13136,[M-H]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467503,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,311.13136,[M-H]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467504,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,311.13136,[M-H]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467505,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,311.13136,[M-H]-,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467506,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,311.13136,[M-H]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467507,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,347.10804,[M+Cl]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467508,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,347.10804,[M+Cl]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467509,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,347.10804,[M+Cl]-,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467510,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,347.10804,[M+Cl]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467511,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,347.10804,[M+Cl]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467512,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467513,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467514,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467515,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467516,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467517,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467518,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467519,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467520,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467521,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,45.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467522,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467523,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467524,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,45.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467525,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467526,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467527,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467528,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467529,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,357.13684,[M+FA]-,15.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467530,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,311.13136,[M-H]-,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467531,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,311.13136,[M-H]-,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467532,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,311.13136,[M-H]-,60.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467533,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,311.13136,[M-H]-,30.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467534,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,311.13136,[M-H]-,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467535,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467536,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467537,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,60.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467538,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,30.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467539,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467540,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,30.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467541,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,20.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467542,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F,313.14592,[M+H]+,60.0,val,COC(C)(CNc1ncnc2ncccc12)c1ccccc1F
467543,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467544,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467545,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,45.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467546,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467547,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467548,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,45.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467549,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,60.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467550,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1,313.14592,[M+H]+,20.0,val,Fc1ccc(OCCNc2nccn3nc(C4CC4)cc23)cc1
467551,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467552,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467553,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,60.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467554,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,15.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467555,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467556,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,60.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467557,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,15.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467558,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,419.09433,[M-H]-,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467559,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,455.071,[M+Cl]-,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467560,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,421.10888,[M+H]+,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467561,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,421.10888,[M+H]+,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467562,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,421.10888,[M+H]+,60.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467563,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,421.10888,[M+H]+,15.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467564,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O,421.10888,[M+H]+,20.0,val,CC(=O)N[C@@H](CSc1nc2c(=O)[nH]c(N)nc2n1Cc1ccc(F)cc1)C(=O)O
467565,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,290.14112,[M-H]-,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467566,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,290.14112,[M-H]-,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467567,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,290.14112,[M-H]-,60.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467568,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,290.14112,[M-H]-,30.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467569,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,290.14112,[M-H]-,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467570,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,292.15567,[M+H]+,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467571,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,292.15567,[M+H]+,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467572,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,292.15567,[M+H]+,60.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467573,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,292.15567,[M+H]+,30.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467574,c1ccc(-c2n[nH]nn2)c(Nc2cccc3c2CCCC3)c1,292.15567,[M+H]+,20.0,val,c1ccc(-c2nn[nH]n2)c(Nc2cccc3c2CCCC3)c1
467575,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,291.14785,[M]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467576,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,291.14785,[M]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467577,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,291.14785,[M]+,60.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467578,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,291.14785,[M]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467579,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,291.14785,[M]+,60.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467580,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467581,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467582,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,60.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467583,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467584,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,60.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467585,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1,292.15567,[M+H]+,20.0,val,Cc1cc(N)nc(Nc2ccc(Nc3ccccc3)cc2)n1
467586,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,20.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467587,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,20.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467588,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,60.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467589,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,20.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467590,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,45.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467591,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,60.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467592,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,20.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467593,Cc1cc(N/C=C/C(=O)c2ccccc2)c(C)cc1,252.13829,[M+H]+,45.0,val,Cc1ccc(C)c(N/C=C/C(=O)c2ccccc2)c1
467594,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,20.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467595,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,20.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467596,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,60.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467597,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,30.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467598,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,20.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467599,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,60.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467600,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,30.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467601,O=C(/C=C/c1ccccc1)NCCc1ccccc1,252.13829,[M+H]+,20.0,val,O=C(/C=C/c1ccccc1)NCCc1ccccc1
467602,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,298.10848,[M-H]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467603,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,298.10848,[M-H]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467604,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,298.10848,[M-H]-,60.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467605,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,298.10848,[M-H]-,30.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467606,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,298.10848,[M-H]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467607,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,344.11396,[M+FA]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467608,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,344.11396,[M+FA]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467609,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,344.11396,[M+FA]-,60.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467610,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,344.11396,[M+FA]-,15.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467611,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,344.11396,[M+FA]-,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467612,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,300.12303,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467613,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,300.12303,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467614,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,300.12303,[M+H]+,60.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467615,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,300.12303,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467616,CCOc1ccc(C(=O)NCc2cc(C(=O)O)ccc2)cc1,300.12303,[M+H]+,45.0,val,CCOc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1
467617,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467618,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467619,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,60.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467620,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,30.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467621,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467622,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467623,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467624,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,60.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467625,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,30.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467626,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467627,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,60.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467628,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,30.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467629,O=C(O)Cc1c(C(=O)N2CCc3ccccc3CC2)cco1,300.12303,[M+H]+,20.0,val,O=C(O)Cc1occc1C(=O)N1CCc2ccccc2CC1
467630,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
467631,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
467632,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1,300.12303,[M+H]+,60.0,val,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
467633,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1,300.12303,[M+H]+,15.0,val,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
467634,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,COC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
467635,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467636,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467637,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,298.10848,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467638,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,298.10848,[M-H]-,30.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467639,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467640,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,282.11247,[M+H-H2O]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467641,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,282.11247,[M+H-H2O]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467642,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,282.11247,[M+H-H2O]+,60.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467643,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,282.11247,[M+H-H2O]+,15.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467644,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,282.11247,[M+H-H2O]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467645,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467646,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467647,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,300.12303,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467648,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,300.12303,[M+H]+,30.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467649,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)NCC(O)c1ccc(O)cc1
467650,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,298.10848,[M-H]-,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467651,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,298.10848,[M-H]-,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467652,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,298.10848,[M-H]-,60.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467653,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,298.10848,[M-H]-,30.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467654,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,298.10848,[M-H]-,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467655,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1
467656,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1
467657,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1,300.12303,[M+H]+,60.0,val,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1
467658,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1,300.12303,[M+H]+,15.0,val,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1
467659,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1,300.12303,[M+H]+,20.0,val,O=C(O)CC(NC(=O)OCc1ccccc1)c1ccccc1
467660,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,300.12303,[M+H]+,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467661,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,300.12303,[M+H]+,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467662,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,300.12303,[M+H]+,60.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467663,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,300.12303,[M+H]+,15.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467664,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1,300.12303,[M+H]+,20.0,val,COc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1
467665,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,334.08516,[M+Cl]-,20.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467666,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,334.08516,[M+Cl]-,60.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467667,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,344.11396,[M+FA]-,60.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467668,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,344.11396,[M+FA]-,15.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467669,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,344.11396,[M+FA]-,20.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467670,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1,298.10848,[M-H]-,20.0,val,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1
467671,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1,298.10848,[M-H]-,20.0,val,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1
467672,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1,298.10848,[M-H]-,60.0,val,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1
467673,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1,298.10848,[M-H]-,15.0,val,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1
467674,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1,298.10848,[M-H]-,20.0,val,O=C(NC[C@@H](C(=O)O)c1ccccc1)OCc1ccccc1
467675,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,300.12303,[M+H]+,20.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467676,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,300.12303,[M+H]+,20.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467677,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,300.12303,[M+H]+,60.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467678,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,300.12303,[M+H]+,30.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467679,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21,300.12303,[M+H]+,20.0,val,O[C@@H]1[C@H](O)COC[C@H]1N1c2ccccc2Oc2ccccc21
467680,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467681,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467682,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,45.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467683,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467684,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467685,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,45.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467686,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467687,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,298.10848,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467688,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,334.08516,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467689,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,334.08516,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467690,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,334.08516,[M+Cl]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467691,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,334.08516,[M+Cl]-,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467692,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467693,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467694,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467695,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,30.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467696,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467697,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467698,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,30.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467699,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1,300.12303,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
467700,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,346.07547,[M-H]-,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467701,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,346.07547,[M-H]-,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467702,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,346.07547,[M-H]-,60.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467703,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,346.07547,[M-H]-,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467704,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,346.07547,[M-H]-,45.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467705,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,348.09002,[M+H]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467706,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,348.09002,[M+H]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467707,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,348.09002,[M+H]+,60.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467708,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,348.09002,[M+H]+,30.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467709,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,348.09002,[M+H]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467710,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,365.11657,[M+NH4]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467711,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,365.11657,[M+NH4]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467712,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,365.11657,[M+NH4]+,60.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467713,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,365.11657,[M+NH4]+,15.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467714,O=C(O)c1cccc(CCNS(=O)(=O)c2cc3c(cc2)OCC3)c1,365.11657,[M+NH4]+,20.0,val,O=C(O)c1cccc(CCNS(=O)(=O)c2ccc3c(c2)CCO3)c1
467715,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1,316.08243,[M+H]+,20.0,val,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1
467716,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1,316.08243,[M+H]+,20.0,val,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1
467717,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1,316.08243,[M+H]+,60.0,val,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1
467718,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1,316.08243,[M+H]+,15.0,val,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1
467719,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1,316.08243,[M+H]+,20.0,val,c1csc(CNCc2ccc(OCc3cccs3)cc2)c1
467720,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467721,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467722,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,60.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467723,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,30.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467724,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467725,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467726,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,30.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467727,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2,304.10988,[M+H]+,60.0,val,COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)NCC2
467728,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,20.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467729,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,20.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467730,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,60.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467731,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,30.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467732,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,20.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467733,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,30.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467734,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,20.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467735,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1,304.10988,[M+H]+,60.0,val,O=C(Oc1ccc2ccccc2c1Cl)N1CCCCCC1
467736,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,20.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467737,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,20.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467738,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,60.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467739,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,30.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467740,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,20.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467741,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,60.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467742,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,30.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467743,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1,304.10988,[M+H]+,20.0,val,CC(Oc1ccccc1Cl)C(=O)NCCc1ccccc1
467744,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1,304.10988,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1
467745,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1,304.10988,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1
467746,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1,304.10988,[M+H]+,60.0,val,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1
467747,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1,304.10988,[M+H]+,30.0,val,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1
467748,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1,304.10988,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)NCCCc1ccccc1
467749,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1,304.10988,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1
467750,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1,304.10988,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1
467751,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1,304.10988,[M+H]+,60.0,val,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1
467752,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1,304.10988,[M+H]+,30.0,val,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1
467753,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1,304.10988,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCc2ccccc2Cl)cc1
467754,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1,304.10988,[M+H]+,20.0,val,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1
467755,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1,304.10988,[M+H]+,20.0,val,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1
467756,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1,304.10988,[M+H]+,60.0,val,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1
467757,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1,304.10988,[M+H]+,30.0,val,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1
467758,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1,304.10988,[M+H]+,20.0,val,CN(C(=O)C(C)(C)Oc1ccc(Cl)cc1)c1ccccc1
467759,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467760,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467761,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467762,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,30.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467763,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467764,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467765,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,30.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467766,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467767,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467768,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467769,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467770,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,15.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467771,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467772,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467773,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467774,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467775,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467776,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467777,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467778,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467779,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,30.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467780,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467781,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467782,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,30.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467783,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,379.10458,[M-H]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467784,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467785,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467786,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467787,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,15.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467788,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,415.08125,[M+Cl]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467789,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467790,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467791,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467792,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,15.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467793,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,425.11006,[M+FA]-,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467794,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467795,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467796,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,30.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467797,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467798,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,15.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467799,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467800,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,60.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467801,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F,381.11913,[M+H]+,20.0,val,O=C(Nc1nnc(C2CCOCC2)s1)N[C@@H]1C[C@H]1c1c(F)cccc1F
467802,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,20.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467803,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,20.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467804,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,60.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467805,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,20.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467806,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,45.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467807,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,60.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467808,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,20.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467809,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cnccc2)n1,366.15362,[M+H]+,45.0,val,FC(F)(F)c1cc(N2CCN(C3COC3)CC2)nc(-c2cccnc2)n1
467810,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,20.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467811,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,20.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467812,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,60.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467813,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,30.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467814,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,20.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467815,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,60.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467816,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,30.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467817,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1,366.15362,[M+H]+,20.0,val,O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCN2CCCC2C1
467818,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,364.13907,[M-H]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467819,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,364.13907,[M-H]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467820,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,364.13907,[M-H]-,60.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467821,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,364.13907,[M-H]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467822,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,364.13907,[M-H]-,60.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467823,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,400.11575,[M+Cl]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467824,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,400.11575,[M+Cl]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467825,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,400.11575,[M+Cl]-,60.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467826,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,400.11575,[M+Cl]-,15.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467827,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,400.11575,[M+Cl]-,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467828,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,15.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467829,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,15.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467830,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467831,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,60.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467832,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,15.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467833,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,45.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467834,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,20.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467835,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1,366.15362,[M+H]+,60.0,val,CN1CCN(c2ncc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)CC1
467836,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1,326.13624,[M+H]+,20.0,val,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1
467837,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1,326.13624,[M+H]+,20.0,val,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1
467838,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1,326.13624,[M+H]+,60.0,val,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1
467839,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1,326.13624,[M+H]+,15.0,val,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1
467840,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1,326.13624,[M+H]+,20.0,val,FC(F)(F)c1cccc(-c2ccc(CNCC3CCCO3)o2)c1
467841,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,340.1166,[M-H]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467842,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,340.1166,[M-H]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467843,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,340.1166,[M-H]-,60.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467844,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,340.1166,[M-H]-,30.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467845,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,340.1166,[M-H]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467846,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,376.09328,[M+Cl]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467847,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,376.09328,[M+Cl]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467848,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,376.09328,[M+Cl]-,15.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467849,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,376.09328,[M+Cl]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467850,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467851,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467852,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,60.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467853,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,15.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467854,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467855,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467856,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,15.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467857,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,386.12208,[M+FA]-,60.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467858,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467859,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467860,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467861,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,30.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467862,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467863,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467864,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,30.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467865,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1,324.12059,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)CCc1ccc(C(F)(F)F)cc1)c1ccco1
467866,Cn1ncc2c1ncn(CC(=O)N1CCN(c3cc(F)cnc3)CC1)c2=O,372.15788,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCN(c4cncc(F)c4)CC3)cnc21
467867,Cn1ncc2c1ncn(CC(=O)N1CCN(c3cc(F)cnc3)CC1)c2=O,372.15788,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCN(c4cncc(F)c4)CC3)cnc21
467868,Cn1ncc2c1ncn(CC(=O)N1CCN(c3cc(F)cnc3)CC1)c2=O,372.15788,[M+H]+,60.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCN(c4cncc(F)c4)CC3)cnc21
467869,Cn1ncc2c1ncn(CC(=O)N1CCN(c3cc(F)cnc3)CC1)c2=O,372.15788,[M+H]+,30.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCN(c4cncc(F)c4)CC3)cnc21
467870,Cn1ncc2c1ncn(CC(=O)N1CCN(c3cc(F)cnc3)CC1)c2=O,372.15788,[M+H]+,20.0,val,Cn1ncc2c(=O)n(CC(=O)N3CCN(c4cncc(F)c4)CC3)cnc21
467871,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467872,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467873,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467874,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467875,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467876,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467877,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467878,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1,320.1115,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1
467879,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,318.09695,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467880,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,318.09695,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467881,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,318.09695,[M-H]-,30.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467882,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,318.09695,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467883,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,364.10243,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467884,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,364.10243,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467885,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,364.10243,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467886,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,364.10243,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467887,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,364.10243,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467888,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,318.09695,[M-H]-,45.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467889,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467890,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467891,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,30.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467892,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,60.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467893,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,15.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467894,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467895,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467896,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,354.07363,[M+Cl]-,60.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467897,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,320.1115,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467898,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,320.1115,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467899,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,320.1115,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467900,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,320.1115,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467901,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1,320.1115,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)C1(c2cccs2)CCOCC1
467902,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467903,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467904,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467905,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,15.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467906,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467907,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467908,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467909,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F,320.1115,[M+H]+,15.0,val,Cc1ccc(C(=O)N2CCSC(c3ccco3)CC2)cc1F
467910,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,320.1115,[M+H]+,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467911,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,320.1115,[M+H]+,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467912,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,320.1115,[M+H]+,60.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467913,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,320.1115,[M+H]+,30.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467914,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1,320.1115,[M+H]+,20.0,val,O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccsc1
467915,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F,320.1115,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F
467916,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F,320.1115,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F
467917,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F,320.1115,[M+H]+,60.0,val,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F
467918,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F,320.1115,[M+H]+,30.0,val,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F
467919,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F,320.1115,[M+H]+,20.0,val,COc1ccc(C(=O)NC2(c3cccs3)CCCC2)cc1F
467920,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467921,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467922,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,30.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467923,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,60.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467924,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467925,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,45.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467926,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467927,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,318.11471,[M-H]-,60.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467928,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,364.12019,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467929,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,364.12019,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467930,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,364.12019,[M+FA]-,60.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467931,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,364.12019,[M+FA]-,15.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467932,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,364.12019,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467933,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,302.1187,[M+H-H2O]+,30.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467934,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,302.1187,[M+H-H2O]+,30.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467935,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,302.1187,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467936,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,302.1187,[M+H-H2O]+,60.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467937,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F,302.1187,[M+H-H2O]+,30.0,val,COc1ccc(C(=O)NCC2(O)CCCc3occc32)cc1F
467938,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467939,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467940,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,60.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467941,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,30.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467942,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467943,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,30.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467944,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467945,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,382.05885,[M-H]-,60.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467946,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467947,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467948,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,60.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467949,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,15.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467950,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467951,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467952,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,60.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467953,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,428.06433,[M+FA]-,15.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467954,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,384.0734,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467955,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,384.0734,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467956,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,384.0734,[M+H]+,60.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467957,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,384.0734,[M+H]+,15.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467958,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1,384.0734,[M+H]+,20.0,val,O=S(=O)(c1ccccc1)C1CCN(S(=O)(=O)Cc2cccc(F)c2)C1
467959,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,329.09654,[M-H]-,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467960,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,329.09654,[M-H]-,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467961,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,329.09654,[M-H]-,60.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467962,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,329.09654,[M-H]-,15.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467963,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,329.09654,[M-H]-,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467964,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,329.09654,[M-H]-,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467965,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,329.09654,[M-H]-,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467966,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,329.09654,[M-H]-,60.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467967,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,329.09654,[M-H]-,15.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467968,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,329.09654,[M-H]-,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467969,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467970,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467971,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,60.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467972,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,30.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467973,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467974,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,60.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467975,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,30.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467976,CN(Cc1c(C(=O)O)scc1)C1CCN(c2ccccc2)C1=O,331.11109,[M+H]+,20.0,val,CN(Cc1ccsc1C(=O)O)C1CCN(c2ccccc2)C1=O
467977,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,331.11109,[M+H]+,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467978,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,331.11109,[M+H]+,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467979,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,331.11109,[M+H]+,60.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467980,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,331.11109,[M+H]+,30.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467981,Cc1c(C(=O)O)sc(CNC(=O)C2CCCc3ccccc32)n1,331.11109,[M+H]+,20.0,val,Cc1nc(CNC(=O)C2CCCc3ccccc32)sc1C(=O)O
467982,CCN(CC)CC(=O)Nc1c2c(=O)oc3ccccc3c2cs1,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
467983,CCN(CC)CC(=O)Nc1c2c(=O)oc3ccccc3c2cs1,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
467984,CCN(CC)CC(=O)Nc1c2c(=O)oc3ccccc3c2cs1,331.11109,[M+H]+,60.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
467985,CCN(CC)CC(=O)Nc1c2c(=O)oc3ccccc3c2cs1,331.11109,[M+H]+,30.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
467986,CCN(CC)CC(=O)Nc1c2c(=O)oc3ccccc3c2cs1,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
467987,COC(=O)CSC1CCN(C(=O)c2nc3ccccc3cc2)C1,331.11109,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2ccc3ccccc3n2)C1
467988,COC(=O)CSC1CCN(C(=O)c2nc3ccccc3cc2)C1,331.11109,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2ccc3ccccc3n2)C1
467989,COC(=O)CSC1CCN(C(=O)c2nc3ccccc3cc2)C1,331.11109,[M+H]+,60.0,val,COC(=O)CSC1CCN(C(=O)c2ccc3ccccc3n2)C1
467990,COC(=O)CSC1CCN(C(=O)c2nc3ccccc3cc2)C1,331.11109,[M+H]+,30.0,val,COC(=O)CSC1CCN(C(=O)c2ccc3ccccc3n2)C1
467991,COC(=O)CSC1CCN(C(=O)c2nc3ccccc3cc2)C1,331.11109,[M+H]+,20.0,val,COC(=O)CSC1CCN(C(=O)c2ccc3ccccc3n2)C1
467992,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467993,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467994,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,45.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467995,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,60.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467996,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467997,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,45.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467998,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,60.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
467999,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,329.09654,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468000,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,329.09654,[M-H]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468001,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,329.09654,[M-H]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468002,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,329.09654,[M-H]-,60.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468003,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,329.09654,[M-H]-,15.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468004,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,329.09654,[M-H]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468005,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,365.07321,[M+Cl]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468006,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,365.07321,[M+Cl]-,60.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468007,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,365.07321,[M+Cl]-,15.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468008,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,365.07321,[M+Cl]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468009,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468010,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468011,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,60.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468012,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,15.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468013,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468014,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468015,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,15.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468016,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,375.10202,[M+FA]-,60.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468017,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468018,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468019,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,45.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468020,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,60.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468021,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468022,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,60.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468023,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,45.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468024,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,329.09654,[M-H]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468025,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,375.10202,[M+FA]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468026,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,375.10202,[M+FA]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468027,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,375.10202,[M+FA]-,60.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468028,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,375.10202,[M+FA]-,15.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468029,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,375.10202,[M+FA]-,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468030,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468031,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468032,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,45.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468033,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,60.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468034,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468035,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,45.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468036,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,60.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468037,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,329.09654,[M-H]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468038,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,365.07321,[M+Cl]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468039,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,365.07321,[M+Cl]-,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468040,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,365.07321,[M+Cl]-,60.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468041,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,331.11109,[M+H]+,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468042,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,331.11109,[M+H]+,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468043,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,331.11109,[M+H]+,60.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468044,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,331.11109,[M+H]+,30.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468045,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,331.11109,[M+H]+,20.0,val,CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1
468046,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21,331.11109,[M+H]+,20.0,val,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21
468047,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21,331.11109,[M+H]+,20.0,val,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21
468048,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21,331.11109,[M+H]+,60.0,val,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21
468049,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21,331.11109,[M+H]+,15.0,val,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21
468050,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21,331.11109,[M+H]+,20.0,val,CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)c2ccccc21
468051,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468052,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468053,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468054,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,30.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468055,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468056,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,30.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468057,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,60.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468058,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C,331.11109,[M+H]+,20.0,val,COc1c(C)cc(S(=O)(=O)n2cnc3ccccc32)c(C)c1C
468059,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,313.10053,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468060,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,313.10053,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468061,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,313.10053,[M+H-H2O]+,60.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468062,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,313.10053,[M+H-H2O]+,15.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468063,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1,313.10053,[M+H-H2O]+,20.0,val,CC(O)(CNC(=O)NCc1cccs1)c1cc2ccccc2o1
468064,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,20.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468065,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,20.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468066,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,30.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468067,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,60.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468068,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,20.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468069,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,45.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468070,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,20.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468071,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,331.11109,[M+H]+,60.0,val,CCOC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1
468072,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468073,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468074,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,60.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468075,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,30.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468076,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468077,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,30.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468078,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,20.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468079,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12,331.11109,[M+H]+,60.0,val,CCN(CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12
468080,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,331.11109,[M+H]+,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468081,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,331.11109,[M+H]+,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468082,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,331.11109,[M+H]+,45.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468083,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,331.11109,[M+H]+,60.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468084,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1,331.11109,[M+H]+,20.0,val,O=C1CC(CNS(=O)(=O)c2ccccc2)CN1c1ccccc1
468085,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,331.11109,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468086,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,331.11109,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468087,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,331.11109,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468088,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,331.11109,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468089,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1,331.11109,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)NC2CC(=O)N(c3ccccc3)C2)cc1
468090,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1,331.11109,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1
468091,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1,331.11109,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1
468092,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1,331.11109,[M+H]+,60.0,val,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1
468093,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1,331.11109,[M+H]+,15.0,val,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1
468094,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1,331.11109,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1
468095,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,331.11109,[M+H]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468096,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,331.11109,[M+H]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468097,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,331.11109,[M+H]+,60.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468098,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,331.11109,[M+H]+,15.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468099,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,331.11109,[M+H]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468100,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,353.09303,[M+Na]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468101,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,353.09303,[M+Na]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468102,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,353.09303,[M+Na]+,60.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468103,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,353.09303,[M+Na]+,30.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468104,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1,353.09303,[M+Na]+,20.0,val,CCCCOc1ccc2cc(S(=O)(=O)n3cccn3)ccc2c1
468105,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468106,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468107,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468108,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468109,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,15.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468110,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468111,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468112,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12,331.11109,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)n2ccnc2CC)c2ccccc12
468113,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,329.1143,[M-H]-,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468114,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,329.1143,[M-H]-,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468115,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,329.1143,[M-H]-,60.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468116,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,329.1143,[M-H]-,15.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468117,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,329.1143,[M-H]-,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468118,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468119,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468120,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,60.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468121,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,30.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468122,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468123,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,30.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468124,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,329.1143,[M-H]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468125,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,375.11977,[M+FA]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468126,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,375.11977,[M+FA]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468127,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,375.11977,[M+FA]-,15.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468128,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,375.11977,[M+FA]-,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468129,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468130,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468131,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,30.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468132,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,60.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468133,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,15.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468134,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468135,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,60.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468136,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1,331.12885,[M+H]+,20.0,val,CCCc1nc(C(=O)N2CCOc3ccccc3C2C(=O)O)co1
468137,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,331.12885,[M+H]+,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468138,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,331.12885,[M+H]+,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468139,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,331.12885,[M+H]+,60.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468140,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,331.12885,[M+H]+,15.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468141,Cc1noc(C2(NC(=O)c3cc(C(=O)O)ccc3)CCOCC2)c1,331.12885,[M+H]+,20.0,val,Cc1cc(C2(NC(=O)c3cccc(C(=O)O)c3)CCOCC2)on1
468142,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468143,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468144,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,60.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468145,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,30.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468146,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468147,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468148,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,30.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468149,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,329.1143,[M-H]-,60.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468150,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,375.11977,[M+FA]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468151,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,375.11977,[M+FA]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468152,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,375.11977,[M+FA]-,60.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468153,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,375.11977,[M+FA]-,15.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468154,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,375.11977,[M+FA]-,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468155,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468156,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468157,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,45.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468158,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,60.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468159,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468160,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,60.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468161,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,45.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468162,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O,331.12885,[M+H]+,20.0,val,CCOc1cn(C)c(C(=O)NCc2ccc3c(c2)OCO3)cc1=O
468163,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,20.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468164,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,20.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468165,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,60.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468166,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,20.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468167,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,60.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468168,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2,311.13249,[M+H]+,20.0,val,CCc1nc(Nc2nc3ccccc3s2)nc2c1CCCC2
468169,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,20.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468170,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,20.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468171,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,45.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468172,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,60.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468173,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,20.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468174,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,45.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468175,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,60.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468176,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1,311.13249,[M+H]+,20.0,val,c1ccc2c(N3CCN(Cc4ccncc4)CC3)nsc2c1
468177,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468178,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468179,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,45.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468180,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,60.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468181,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468182,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468183,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468184,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,45.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468185,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,60.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468186,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468187,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,45.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468188,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,60.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468189,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1,311.13249,[M+H]+,20.0,val,Cc1cccc(N2CCN(c3ncnc4ccsc34)CC2)c1
468190,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,20.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468191,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,20.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468192,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,60.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468193,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,30.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468194,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,20.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468195,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,60.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468196,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,30.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468197,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1,311.13249,[M+H]+,20.0,val,Cc1ccc(CSc2nnc(-c3ccc(N)cc3)n2C)cc1
468198,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,369.11392,[M-H]-,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468199,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,369.11392,[M-H]-,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468200,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,369.11392,[M-H]-,60.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468201,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,369.11392,[M-H]-,30.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468202,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,369.11392,[M-H]-,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468203,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,369.11392,[M-H]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468204,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,369.11392,[M-H]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468205,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,369.11392,[M-H]-,60.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468206,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,369.11392,[M-H]-,30.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468207,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,369.11392,[M-H]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468208,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,405.0906,[M+Cl]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468209,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,405.0906,[M+Cl]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468210,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,405.0906,[M+Cl]-,60.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468211,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,405.0906,[M+Cl]-,15.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468212,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,405.0906,[M+Cl]-,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468213,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468214,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468215,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,15.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468216,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,60.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468217,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,30.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468218,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468219,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,60.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468220,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1c(-c2nccs2)[nH]nc1,371.12847,[M+H]+,20.0,val,CN(C)C(=O)Cc1ccccc1NC(=O)Nc1cn[nH]c1-c1nccs1
468221,O=C(CN1CCN(c2nccnc2)CC1)Nc1nc(-c2ccco2)cs1,371.12847,[M+H]+,20.0,val,O=C(CN1CCN(c2cnccn2)CC1)Nc1nc(-c2ccco2)cs1
468222,O=C(CN1CCN(c2nccnc2)CC1)Nc1nc(-c2ccco2)cs1,371.12847,[M+H]+,20.0,val,O=C(CN1CCN(c2cnccn2)CC1)Nc1nc(-c2ccco2)cs1
468223,O=C(CN1CCN(c2nccnc2)CC1)Nc1nc(-c2ccco2)cs1,371.12847,[M+H]+,60.0,val,O=C(CN1CCN(c2cnccn2)CC1)Nc1nc(-c2ccco2)cs1
468224,O=C(CN1CCN(c2nccnc2)CC1)Nc1nc(-c2ccco2)cs1,371.12847,[M+H]+,30.0,val,O=C(CN1CCN(c2cnccn2)CC1)Nc1nc(-c2ccco2)cs1
468225,O=C(CN1CCN(c2nccnc2)CC1)Nc1nc(-c2ccco2)cs1,371.12847,[M+H]+,20.0,val,O=C(CN1CCN(c2cnccn2)CC1)Nc1nc(-c2ccco2)cs1
468226,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,371.12847,[M+H]+,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468227,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,371.12847,[M+H]+,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468228,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,371.12847,[M+H]+,60.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468229,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,371.12847,[M+H]+,30.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468230,COc1ncnc(NC(=O)C2CCCN(c3c4ccsc4ncn3)C2)c1,371.12847,[M+H]+,20.0,val,COc1cc(NC(=O)C2CCCN(c3ncnc4sccc34)C2)ncn1
468231,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,365.13024,[M-H]-,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468232,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,365.13024,[M-H]-,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468233,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,365.13024,[M-H]-,45.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468234,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,365.13024,[M-H]-,60.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468235,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,365.13024,[M-H]-,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468236,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468237,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468238,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,45.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468239,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,60.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468240,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468241,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,45.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468242,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,60.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468243,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1,367.14479,[M+H]+,20.0,val,c1csc(-c2[nH]ncc2CN2CCN(c3cnn4cnnc4c3)CC2)c1
468244,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468245,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468246,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,60.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468247,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,15.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468248,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468249,O=C(O)c1c(O)c2ccccc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,365.08781,[M-H]-,20.0,val,O=C(O)c1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc2c1O
468250,O=C(O)c1c(O)c2ccccc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,365.08781,[M-H]-,20.0,val,O=C(O)c1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc2c1O
468251,O=C(O)c1c(O)c2ccccc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,365.08781,[M-H]-,20.0,val,O=C(O)c1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc2c1O
468252,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468253,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468254,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,60.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468255,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,15.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468256,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468257,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,60.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468258,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,15.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468259,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,384.1289,[M+NH4]+,20.0,val,O=C(O)/C=C/c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468260,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468261,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468262,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,60.0,val,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468263,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,30.0,val,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468264,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1cc2ccoc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468265,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468266,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468267,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,60.0,val,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468268,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,15.0,val,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468269,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,365.08781,[M-H]-,20.0,val,O=C(O)/C=C\c1ccc2occc2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
468270,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468271,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468272,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,60.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468273,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,30.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468274,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468275,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,60.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468276,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,30.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468277,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,405.05678,[M-H]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468278,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,451.06226,[M+FA]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468279,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,451.06226,[M+FA]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468280,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,451.06226,[M+FA]-,60.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468281,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,451.06226,[M+FA]-,15.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468282,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,451.06226,[M+FA]-,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468283,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,407.07133,[M+H]+,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468284,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,407.07133,[M+H]+,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468285,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,407.07133,[M+H]+,60.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468286,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,407.07133,[M+H]+,30.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468287,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cn(CC(=O)NC2CC2)nc1,407.07133,[M+H]+,20.0,val,C[C@H](Oc1ccc(Br)cc1)C(=O)Nc1cnn(CC(=O)NC2CC2)c1
468288,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,405.05678,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468289,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,405.05678,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468290,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,405.05678,[M-H]-,45.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468291,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,405.05678,[M-H]-,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468292,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,405.05678,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468293,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,441.03345,[M+Cl]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468294,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,441.03345,[M+Cl]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468295,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,441.03345,[M+Cl]-,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468296,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468297,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468298,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468299,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,15.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468300,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468301,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468302,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,15.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468303,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,451.06226,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468304,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468305,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468306,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468307,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,30.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468308,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468309,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,30.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468310,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,60.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468311,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1,407.07133,[M+H]+,20.0,val,COc1ccc(Br)c(C(=O)N2CCC(n3cc(NC(C)=O)cn3)C2)c1
468312,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,424.09487,[M+FA]-,15.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468313,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,424.09487,[M+FA]-,60.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468314,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,424.09487,[M+FA]-,15.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468315,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,20.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468316,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,20.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468317,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,60.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468318,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,30.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468319,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,20.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468320,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,60.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468321,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,30.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468322,O=C(CN1CCN(c2nc3cc(Cl)c(Cl)cc3nc2)CC1)NC1CC1,380.10394,[M+H]+,20.0,val,O=C(CN1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1)NC1CC1
468323,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468324,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468325,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,15.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468326,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468327,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,30.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468328,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468329,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468330,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,394.0843,[M-H]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468331,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,430.06098,[M+Cl]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468332,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468333,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468334,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468335,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,15.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468336,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468337,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468338,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,15.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468339,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,440.08978,[M+FA]-,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468340,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468341,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468342,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,30.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468343,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468344,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,15.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468345,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468346,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,60.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468347,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2c(Cl)ccc(Cl)c2)n1C,396.09886,[M+H]+,20.0,val,Cc1nnc(CNC(=O)C2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1C
468348,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468349,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468350,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,60.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468351,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468352,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,45.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468353,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,60.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468354,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468355,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,394.0843,[M-H]-,45.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468356,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,430.06098,[M+Cl]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468357,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,430.06098,[M+Cl]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468358,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,430.06098,[M+Cl]-,15.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468359,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,430.06098,[M+Cl]-,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468360,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,378.0883,[M+H-H2O]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468361,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,378.0883,[M+H-H2O]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468362,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,378.0883,[M+H-H2O]+,60.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468363,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,378.0883,[M+H-H2O]+,30.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468364,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,378.0883,[M+H-H2O]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468365,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,396.09886,[M+H]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468366,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,396.09886,[M+H]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468367,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,396.09886,[M+H]+,60.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468368,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,396.09886,[M+H]+,15.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468369,Cn1c(=O)n(CCC(C)(C)O)c2c1ccc(Nc1nc(Cl)ncc1Cl)c2,396.09886,[M+H]+,20.0,val,Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(Cl)ncc3Cl)ccc21
468370,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468371,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468372,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468373,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468374,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468375,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,398.07469,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468376,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,400.08924,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468377,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,400.08924,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468378,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,400.08924,[M+H]+,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468379,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,400.08924,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468380,CC(C)CN1CCn2cc(S(=O)(=O)Nc3c(F)cc(Cl)cc3)cc2C1=O,400.08924,[M+H]+,45.0,val,CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3F)cc2C1=O
468381,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468382,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468383,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,60.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468384,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,30.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468385,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468386,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,60.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468387,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,30.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468388,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,381.06813,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468389,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,383.08268,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468390,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,383.08268,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468391,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,383.08268,[M+H]+,60.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468392,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,383.08268,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468393,Cc1c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc(Cl)cc1,383.08268,[M+H]+,45.0,val,Cc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1
468394,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,329.11746,[M-H]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468395,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,329.11746,[M-H]-,60.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468396,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,329.11746,[M-H]-,30.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468397,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,329.11746,[M-H]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468398,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,365.09414,[M+Cl]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468399,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,365.09414,[M+Cl]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468400,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,365.09414,[M+Cl]-,15.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468401,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,375.12294,[M+FA]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468402,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,375.12294,[M+FA]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468403,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,375.12294,[M+FA]-,60.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468404,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,375.12294,[M+FA]-,15.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468405,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,375.12294,[M+FA]-,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468406,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468407,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468408,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,60.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468409,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,15.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468410,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468411,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,60.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468412,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,15.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468413,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,375.12294,[M+FA]-,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468414,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,331.13201,[M+H]+,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468415,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,331.13201,[M+H]+,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468416,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,331.13201,[M+H]+,60.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468417,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,331.13201,[M+H]+,30.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468418,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2,331.13201,[M+H]+,20.0,val,Cn1nnc2c1CCC(NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)C2
468419,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468420,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468421,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,60.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468422,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,15.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468423,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468424,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,45.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468425,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,60.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468426,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2c1c(Cl)ccc2,331.13201,[M+H]+,20.0,val,CC1(C)CN(C(=O)C2CCc3nncn3C2)c2cccc(Cl)c21
468427,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468428,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468429,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,60.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468430,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,30.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468431,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468432,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468433,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,30.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468434,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,329.11746,[M-H]-,60.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468435,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,365.09414,[M+Cl]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468436,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,365.09414,[M+Cl]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468437,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,365.09414,[M+Cl]-,15.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468438,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,375.12294,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468439,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,375.12294,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468440,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,375.12294,[M+FA]-,60.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468441,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,375.12294,[M+FA]-,15.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468442,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,375.12294,[M+FA]-,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468443,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,329.11746,[M-H]-,20.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468444,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,329.11746,[M-H]-,20.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468445,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,329.11746,[M-H]-,60.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468446,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,329.11746,[M-H]-,30.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468447,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,329.11746,[M-H]-,20.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468448,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,20.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468449,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,20.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468450,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,60.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468451,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,30.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468452,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,20.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468453,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,30.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468454,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,20.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468455,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1,331.13201,[M+H]+,60.0,val,O=c1c(N2CCN(c3ccccc3Cl)CC2)nccn1C1CC1
468456,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468457,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468458,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468459,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468460,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468461,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCCCC2)nc1
468462,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,30.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468463,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,30.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468464,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,20.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468465,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,60.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468466,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,30.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468467,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,60.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468468,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,20.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468469,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1,331.13201,[M+H]+,30.0,val,O=C(c1cc(C2CC2)[nH]n1)N1CCN(c2ccc(Cl)cc2)CC1
468470,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2
468471,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2
468472,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2,331.13201,[M+H]+,60.0,val,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2
468473,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2,331.13201,[M+H]+,30.0,val,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2
468474,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2,331.13201,[M+H]+,20.0,val,O=C(Cc1ccc(Cl)cc1)N1C2CCC1CC(n1ccnn1)C2
468475,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,20.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468476,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,20.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468477,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,45.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468478,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,60.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468479,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,20.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468480,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,45.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468481,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,60.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468482,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12,331.13201,[M+H]+,20.0,val,CCCCOc1nnc(C)c2c(C)n(-c3ccccc3Cl)nc12
468483,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,318.14234,[M-H]-,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468484,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,318.14234,[M-H]-,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468485,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,318.14234,[M-H]-,60.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468486,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,318.14234,[M-H]-,30.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468487,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,318.14234,[M-H]-,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468488,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468489,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468490,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,60.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468491,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,30.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468492,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468493,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,60.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468494,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,30.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468495,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F,320.15689,[M+H]+,20.0,val,CC(NC(=O)CC1C=CCC1)c1nc2ccccc2n1C(F)F
468496,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468497,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468498,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,15.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468499,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468500,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468501,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468502,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468503,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468504,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,45.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468505,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468506,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468507,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,60.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468508,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,30.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468509,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468510,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,60.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468511,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,30.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468512,Fc1cc(CN2CCC(COc3nccnc3)CC2)c(F)cc1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468513,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468514,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468515,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,15.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468516,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468517,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,15.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468518,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468519,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,364.14782,[M+FA]-,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468520,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468521,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468522,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,30.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468523,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,60.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468524,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,15.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468525,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468526,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,60.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468527,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1,320.15689,[M+H]+,20.0,val,Fc1ccc(F)c(CN2CCC(COc3cnccn3)CC2)c1
468528,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468529,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468530,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,45.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468531,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468532,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468533,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,45.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468534,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,60.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468535,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1,320.15689,[M+H]+,20.0,val,O=C(C1CCC(F)(F)CC1)N1CC(n2cnc3ccccc32)C1
468536,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,350.11441,[M-H]-,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468537,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,350.11441,[M-H]-,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468538,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,350.11441,[M-H]-,30.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468539,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,350.11441,[M-H]-,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468540,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468541,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468542,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,60.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468543,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468544,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,45.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468545,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,60.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468546,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,20.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468547,Cc1c(C(=O)Nc2c(F)cc(F)cc2)sc(NC2CCCCC2)n1,352.12897,[M+H]+,45.0,val,Cc1nc(NC2CCCCC2)sc1C(=O)Nc1ccc(F)cc1F
468548,Cc1c(F)c(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)ncn1,401.12536,[M+H]+,20.0,val,Cc1ncnc(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)c1F
468549,Cc1c(F)c(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)ncn1,401.12536,[M+H]+,20.0,val,Cc1ncnc(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)c1F
468550,Cc1c(F)c(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)ncn1,401.12536,[M+H]+,60.0,val,Cc1ncnc(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)c1F
468551,Cc1c(F)c(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)ncn1,401.12536,[M+H]+,20.0,val,Cc1ncnc(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)c1F
468552,Cc1c(F)c(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)ncn1,401.12536,[M+H]+,45.0,val,Cc1ncnc(N(C)C2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)c1F
468553,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,333.10785,[M-H]-,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468554,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,333.10785,[M-H]-,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468555,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,333.10785,[M-H]-,60.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468556,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,333.10785,[M-H]-,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468557,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,333.10785,[M-H]-,45.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468558,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468559,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468560,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,60.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468561,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,30.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468562,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468563,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,60.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468564,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,30.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468565,Cc1c(Cc2ccc(F)cc2)sc(NC(=O)C2CCCOC2)n1,335.1224,[M+H]+,20.0,val,Cc1nc(NC(=O)C2CCCOC2)sc1Cc1ccc(F)cc1
468566,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,333.10785,[M-H]-,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468567,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,333.10785,[M-H]-,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468568,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,333.10785,[M-H]-,60.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468569,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,333.10785,[M-H]-,30.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468570,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,333.10785,[M-H]-,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468571,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468572,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468573,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,15.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468574,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468575,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,30.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468576,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468577,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468578,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,333.10785,[M-H]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468579,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468580,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468581,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468582,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,15.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468583,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468584,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,15.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468585,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468586,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,369.08453,[M+Cl]-,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468587,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,379.11333,[M+FA]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468588,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,379.11333,[M+FA]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468589,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,379.11333,[M+FA]-,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468590,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,379.11333,[M+FA]-,15.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468591,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,379.11333,[M+FA]-,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468592,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468593,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468594,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,60.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468595,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,30.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468596,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468597,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,30.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468598,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,20.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468599,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2,335.1224,[M+H]+,60.0,val,CCC(Oc1ccc(F)cc1)C(=O)Nc1nc2c(s1)CCCC2
468600,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,20.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468601,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,20.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468602,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,60.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468603,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,15.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468604,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,20.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468605,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,20.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468606,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,60.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468607,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F,335.1224,[M+H]+,15.0,val,Cc1ccc(CCC(=O)N2CCC(Oc3nccs3)C2)cc1F
468608,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468609,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468610,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468611,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,30.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468612,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468613,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,60.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468614,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,30.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468615,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1,335.1224,[M+H]+,20.0,val,COc1cc(NC(=S)NCCc2ccc(F)cc2)cc(OC)c1
468616,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468617,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468618,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468619,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468620,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468621,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,45.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468622,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468623,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468624,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1,335.1224,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)NC1CCN(Cc2ccsc2)C1
468625,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,360.08459,[M-H]-,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468626,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,360.08459,[M-H]-,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468627,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,360.08459,[M-H]-,60.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468628,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,360.08459,[M-H]-,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468629,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468630,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468631,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,60.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468632,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,30.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468633,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468634,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,60.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468635,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,30.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468636,CCCSc1nnc(NC(=O)c2c(C)c3c(o2)c(C)c(C)cc3)s1,362.09914,[M+H]+,20.0,val,CCCSc1nnc(NC(=O)c2oc3c(C)c(C)ccc3c2C)s1
468637,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468638,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468639,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,60.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468640,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,30.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468641,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468642,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,60.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468643,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,30.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468644,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,340.14151,[M-H]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468645,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,376.11819,[M+Cl]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468646,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,376.11819,[M+Cl]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468647,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,376.11819,[M+Cl]-,60.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468648,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,376.11819,[M+Cl]-,15.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468649,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,376.11819,[M+Cl]-,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468650,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468651,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468652,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,60.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468653,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468654,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,45.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468655,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,60.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468656,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468657,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,340.14151,[M-H]-,45.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468658,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,376.11819,[M+Cl]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468659,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,376.11819,[M+Cl]-,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468660,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,376.11819,[M+Cl]-,60.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468661,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,376.11819,[M+Cl]-,15.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468662,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468663,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468664,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,60.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468665,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,30.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468666,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468667,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,60.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468668,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,30.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468669,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1,342.15607,[M+H]+,20.0,val,COC(=O)C(C)(Cn1cnc2ccccc21)NC(=O)Cn1cccn1
468670,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1,342.15607,[M+H]+,20.0,val,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1
468671,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1,342.15607,[M+H]+,20.0,val,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1
468672,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1,342.15607,[M+H]+,60.0,val,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1
468673,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1,342.15607,[M+H]+,30.0,val,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1
468674,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1,342.15607,[M+H]+,20.0,val,Cn1ccc(-c2cc(C(=O)N3CCN(Cc4ccco4)CC3)no2)n1
468675,COc1ccc(Cn2nnc(C(=O)NCc3noc(C)c3)c2C)cc1,342.15607,[M+H]+,20.0,val,COc1ccc(Cn2nnc(C(=O)NCc3cc(C)on3)c2C)cc1
468676,COc1ccc(Cn2nnc(C(=O)NCc3noc(C)c3)c2C)cc1,342.15607,[M+H]+,20.0,val,COc1ccc(Cn2nnc(C(=O)NCc3cc(C)on3)c2C)cc1
468677,COc1ccc(Cn2nnc(C(=O)NCc3noc(C)c3)c2C)cc1,342.15607,[M+H]+,60.0,val,COc1ccc(Cn2nnc(C(=O)NCc3cc(C)on3)c2C)cc1
468678,COc1ccc(Cn2nnc(C(=O)NCc3noc(C)c3)c2C)cc1,342.15607,[M+H]+,15.0,val,COc1ccc(Cn2nnc(C(=O)NCc3cc(C)on3)c2C)cc1
468679,COc1ccc(Cn2nnc(C(=O)NCc3noc(C)c3)c2C)cc1,342.15607,[M+H]+,20.0,val,COc1ccc(Cn2nnc(C(=O)NCc3cc(C)on3)c2C)cc1
468680,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468681,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468682,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,60.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468683,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,30.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468684,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468685,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,60.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468686,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,30.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468687,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C,342.15607,[M+H]+,20.0,val,CN1C(=O)CC(C(=O)Nc2cccc(C(N)=O)c2)C1c1ccnn1C
468688,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468689,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468690,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,60.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468691,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,30.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468692,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468693,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,30.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468694,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468695,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,340.14151,[M-H]-,60.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468696,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468697,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468698,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,45.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468699,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,60.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468700,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468701,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,60.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468702,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,45.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468703,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,340.14151,[M-H]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468704,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,376.11819,[M+Cl]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468705,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,376.11819,[M+Cl]-,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468706,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,376.11819,[M+Cl]-,60.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468707,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468708,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468709,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,45.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468710,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,60.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468711,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468712,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,45.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468713,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,60.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468714,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,340.14151,[M-H]-,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468715,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,386.14699,[M+FA]-,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468716,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,386.14699,[M+FA]-,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468717,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,386.14699,[M+FA]-,60.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468718,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,386.14699,[M+FA]-,15.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468719,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,386.14699,[M+FA]-,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468720,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468721,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468722,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,60.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468723,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,30.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468724,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468725,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,30.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468726,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,20.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468727,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1,342.15607,[M+H]+,60.0,val,Cc1cc(=O)nc(-n2nc(-c3ccco3)cc2NC(=O)C(C)(C)C)[nH]1
468728,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468729,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468730,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,60.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468731,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,30.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468732,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468733,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,60.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468734,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,30.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468735,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O,342.15607,[M+H]+,20.0,val,COc1cn(CC(=O)NCCc2nnc3ccccn23)c(C)cc1=O
468736,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,342.15607,[M+H]+,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468737,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,342.15607,[M+H]+,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468738,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,342.15607,[M+H]+,45.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468739,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,342.15607,[M+H]+,60.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468740,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21,342.15607,[M+H]+,20.0,val,CCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n(C)c(=O)n(C)c21
468741,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,20.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468742,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,20.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468743,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,45.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468744,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,60.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468745,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,20.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468746,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,60.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468747,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,45.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468748,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1,342.15607,[M+H]+,20.0,val,COc1cc(OC)nc(N2CCN(c3nc4ccccc4o3)CC2)n1
468749,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468750,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468751,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,30.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468752,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,60.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468753,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468754,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,45.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468755,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,60.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468756,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1,342.15607,[M+H]+,20.0,val,Cc1noc(CCNC(=O)CCCc2nc(=O)c3ccccc3[nH]2)n1
468757,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468758,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468759,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,60.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468760,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,30.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468761,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468762,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,60.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468763,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,30.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468764,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4cscc4)o3)CC2)n1,374.12814,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)n1
468765,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468766,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468767,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,45.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468768,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468769,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468770,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,45.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468771,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468772,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,372.11358,[M-H]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468773,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,408.09026,[M+Cl]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468774,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,408.09026,[M+Cl]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468775,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,408.09026,[M+Cl]-,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468776,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,408.09026,[M+Cl]-,15.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468777,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,408.09026,[M+Cl]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468778,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,418.11906,[M+FA]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468779,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,418.11906,[M+FA]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468780,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,418.11906,[M+FA]-,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468781,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,418.11906,[M+FA]-,15.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468782,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,418.11906,[M+FA]-,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468783,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468784,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468785,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,60.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468786,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468787,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,60.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468788,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,372.11358,[M-H]-,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468789,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,374.12814,[M+H]+,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468790,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,374.12814,[M+H]+,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468791,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,374.12814,[M+H]+,45.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468792,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,374.12814,[M+H]+,60.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468793,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1,374.12814,[M+H]+,20.0,val,CN(C)S(=O)(=O)N1CCc2c(nc3cc(-c4ccccc4)[nH]n3c2=O)C1
468794,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468795,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468796,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468797,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,30.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468798,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468799,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,30.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468800,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468801,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1,374.12814,[M+H]+,60.0,val,Cn1cnc(S(=O)(=O)N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1
468802,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,398.15823,[M+FA]-,20.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468803,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,398.15823,[M+FA]-,60.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468804,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,398.15823,[M+FA]-,15.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468805,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,398.15823,[M+FA]-,20.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468806,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,352.15275,[M-H]-,15.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468807,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,352.15275,[M-H]-,15.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468808,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,352.15275,[M-H]-,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468809,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,352.15275,[M-H]-,60.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468810,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,352.15275,[M-H]-,15.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468811,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,398.15823,[M+FA]-,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468812,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,398.15823,[M+FA]-,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468813,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,398.15823,[M+FA]-,60.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468814,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,398.15823,[M+FA]-,15.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468815,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,398.15823,[M+FA]-,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468816,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,354.1673,[M+H]+,20.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468817,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,354.1673,[M+H]+,20.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468818,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,354.1673,[M+H]+,60.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468819,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,354.1673,[M+H]+,20.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468820,Cc1cn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)nc1,354.1673,[M+H]+,45.0,val,Cc1cnn(C2CCCN(C(=O)c3ccnc4c(C(N)=O)cnn34)C2)c1
468821,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,354.1673,[M+H]+,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468822,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,354.1673,[M+H]+,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468823,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,354.1673,[M+H]+,60.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468824,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,354.1673,[M+H]+,15.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468825,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cn(CC2CCCO2)nc1,354.1673,[M+H]+,20.0,val,O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cnn(CC2CCCO2)c1
468826,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,352.15275,[M-H]-,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468827,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,352.15275,[M-H]-,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468828,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,352.15275,[M-H]-,60.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468829,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,352.15275,[M-H]-,30.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468830,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,352.15275,[M-H]-,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468831,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468832,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468833,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,60.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468834,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,30.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468835,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468836,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,60.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468837,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,30.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468838,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12,354.1673,[M+H]+,20.0,val,CC(NC(=O)CCCNC(=O)c1cnccn1)c1nnc2ccccn12
468839,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1,354.1673,[M+H]+,20.0,val,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1
468840,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1,354.1673,[M+H]+,20.0,val,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1
468841,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1,354.1673,[M+H]+,60.0,val,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1
468842,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1,354.1673,[M+H]+,15.0,val,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1
468843,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1,354.1673,[M+H]+,20.0,val,Cc1cc(C)n2nc(C(=O)N3CCCC(Oc4cccnn4)C3)nc2n1
468844,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,20.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468845,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,20.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468846,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,60.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468847,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,30.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468848,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,20.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468849,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,60.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468850,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,30.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468851,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1,302.13868,[M+H]+,20.0,val,COc1cccc(C2CCCN2Cc2cc(C(=O)O)co2)c1
468852,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,346.12961,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468853,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,346.12961,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468854,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,346.12961,[M+FA]-,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468855,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,346.12961,[M+FA]-,15.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468856,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,346.12961,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468857,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,284.12812,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468858,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,284.12812,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468859,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,284.12812,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468860,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,284.12812,[M+H-H2O]+,30.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468861,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1,284.12812,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2ccco2)o1)C1CC=CCC1
468862,O=C(C1OC1/C=C/c1cc2c(cc1)OCO2)N1CCCCC1,302.13868,[M+H]+,20.0,val,O=C(C1OC1/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
468863,O=C(C1OC1/C=C/c1cc2c(cc1)OCO2)N1CCCCC1,302.13868,[M+H]+,20.0,val,O=C(C1OC1/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
468864,O=C(C1OC1/C=C/c1cc2c(cc1)OCO2)N1CCCCC1,302.13868,[M+H]+,60.0,val,O=C(C1OC1/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
468865,O=C(C1OC1/C=C/c1cc2c(cc1)OCO2)N1CCCCC1,302.13868,[M+H]+,15.0,val,O=C(C1OC1/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
468866,O=C(C1OC1/C=C/c1cc2c(cc1)OCO2)N1CCCCC1,302.13868,[M+H]+,20.0,val,O=C(C1OC1/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
468867,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,300.12413,[M-H]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468868,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,300.12413,[M-H]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468869,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,300.12413,[M-H]-,60.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468870,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,300.12413,[M-H]-,30.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468871,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,300.12413,[M-H]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468872,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,346.12961,[M+FA]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468873,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,346.12961,[M+FA]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468874,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,346.12961,[M+FA]-,60.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468875,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,346.12961,[M+FA]-,15.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468876,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,346.12961,[M+FA]-,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468877,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1,300.12413,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1
468878,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1,300.12413,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1
468879,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1,300.12413,[M-H]-,60.0,val,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1
468880,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1,300.12413,[M-H]-,15.0,val,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1
468881,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1,300.12413,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1
468882,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468883,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468884,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468885,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468886,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468887,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468888,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468889,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,300.12413,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468890,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,284.12812,[M+H-H2O]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468891,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,284.12812,[M+H-H2O]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468892,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,284.12812,[M+H-H2O]+,45.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468893,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,284.12812,[M+H-H2O]+,60.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468894,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,284.12812,[M+H-H2O]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468895,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,302.13868,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468896,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,302.13868,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468897,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,302.13868,[M+H]+,60.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468898,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,302.13868,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468899,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1,302.13868,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)C2C3CCC(C3)C2C(=O)O)c1
468900,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1,302.13868,[M+H]+,15.0,val,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1
468901,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1,302.13868,[M+H]+,15.0,val,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1
468902,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1,302.13868,[M+H]+,20.0,val,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1
468903,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1,302.13868,[M+H]+,60.0,val,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1
468904,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1,302.13868,[M+H]+,15.0,val,CCOC(=O)c1oc2ccccc2c1NC(=O)C1CCCC1
468905,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1,302.13868,[M+H]+,20.0,val,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1
468906,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1,302.13868,[M+H]+,20.0,val,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1
468907,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1,302.13868,[M+H]+,60.0,val,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1
468908,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1,302.13868,[M+H]+,15.0,val,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1
468909,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1,302.13868,[M+H]+,20.0,val,CCc1cccc(CC)c1NC(=O)COC(=O)c1ccco1
468910,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468911,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468912,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,60.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468913,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,15.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468914,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468915,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,45.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468916,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,20.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468917,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O,302.13868,[M+H]+,60.0,val,CCOc1coc(C(=O)NCCCc2ccccc2)cc1=O
468918,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,20.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468919,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,20.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468920,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,60.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468921,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,30.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468922,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,20.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468923,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,30.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468924,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,60.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468925,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O,302.13868,[M+H]+,20.0,val,COC(=O)c1c(O)cc(C(C)(C)C)n(-c2ccccc2)c1=O
468926,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12,302.13868,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12
468927,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12,302.13868,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12
468928,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12,302.13868,[M+H]+,60.0,val,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12
468929,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12,302.13868,[M+H]+,30.0,val,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12
468930,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12,302.13868,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12
468931,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1,412.02237,[M-H]-,20.0,val,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1
468932,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1,412.02237,[M-H]-,20.0,val,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1
468933,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1,412.02237,[M-H]-,60.0,val,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1
468934,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1,412.02237,[M-H]-,30.0,val,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1
468935,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1,412.02237,[M-H]-,20.0,val,Cc1ccc(C(CNS(=O)(=O)c2ccccc2Br)OCCO)cc1
468936,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,385.07274,[M-H]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468937,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,385.07274,[M-H]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468938,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,385.07274,[M-H]-,60.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468939,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,385.07274,[M-H]-,30.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468940,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,385.07274,[M-H]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468941,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,431.07821,[M+FA]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468942,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,431.07821,[M+FA]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468943,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,431.07821,[M+FA]-,60.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468944,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,431.07821,[M+FA]-,15.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468945,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,431.07821,[M+FA]-,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468946,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,387.08729,[M+H]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468947,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,387.08729,[M+H]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468948,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,387.08729,[M+H]+,60.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468949,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,387.08729,[M+H]+,15.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468950,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,387.08729,[M+H]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468951,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,409.06923,[M+Na]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468952,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,409.06923,[M+Na]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468953,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,409.06923,[M+Na]+,60.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468954,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,409.06923,[M+Na]+,20.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468955,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,409.06923,[M+Na]+,45.0,val,COC(=O)C(C)CNC(=O)C1CCCN1C(=O)c1cc(Cl)cc(Cl)c1
468956,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,20.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468957,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,20.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468958,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,60.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468959,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,20.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468960,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,45.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468961,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,60.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468962,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,20.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468963,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cc(Cl)ccc2)C1,318.13677,[M+H]+,45.0,val,Cc1n[nH]c(C)c1CC(=O)NC1CC(c2cccc(Cl)c2)C1
468964,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,20.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468965,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,20.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468966,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,60.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468967,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,20.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468968,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,45.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468969,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,60.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468970,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,20.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468971,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1,318.13677,[M+H]+,45.0,val,Clc1ccc(Cc2noc(CC3CC4CCC(C3)N4)n2)cc1
468972,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1,318.13677,[M+H]+,20.0,val,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1
468973,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1,318.13677,[M+H]+,20.0,val,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1
468974,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1,318.13677,[M+H]+,60.0,val,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1
468975,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1,318.13677,[M+H]+,30.0,val,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1
468976,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1,318.13677,[M+H]+,20.0,val,CN1CCN(C(=O)Cc2cccn2-c2cccc(Cl)c2)CC1
468977,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1,318.13677,[M+H]+,20.0,val,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1
468978,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1,318.13677,[M+H]+,20.0,val,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1
468979,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1,318.13677,[M+H]+,60.0,val,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1
468980,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1,318.13677,[M+H]+,15.0,val,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1
468981,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1,318.13677,[M+H]+,20.0,val,Clc1cnccc1OCC1CCN(Cc2ccccn2)CC1
468982,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,20.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468983,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,20.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468984,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,45.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468985,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,60.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468986,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,20.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468987,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,60.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468988,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1,318.13677,[M+H]+,20.0,val,Cn1cncc1C1CCCN(C(=O)Cc2ccccc2Cl)C1
468989,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,20.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468990,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,20.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468991,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,60.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468992,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,30.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468993,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,20.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468994,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,30.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468995,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,60.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468996,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1,318.13677,[M+H]+,20.0,val,Clc1ccc2oc(N3CC(N4CC5CCCC5C4)C3)nc2c1
468997,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cc(Cl)ccc3)cn2)CC1,382.09867,[M+H]+,20.0,val,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cccc(Cl)c3)cn2)CC1
468998,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cc(Cl)ccc3)cn2)CC1,382.09867,[M+H]+,20.0,val,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cccc(Cl)c3)cn2)CC1
468999,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cc(Cl)ccc3)cn2)CC1,382.09867,[M+H]+,60.0,val,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cccc(Cl)c3)cn2)CC1
469000,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cc(Cl)ccc3)cn2)CC1,382.09867,[M+H]+,20.0,val,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cccc(Cl)c3)cn2)CC1
469001,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cc(Cl)ccc3)cn2)CC1,382.09867,[M+H]+,45.0,val,CS(=O)(=O)CC1CCN(C(=O)c2cn(-c3cccc(Cl)c3)cn2)CC1
469002,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,380.08411,[M-H]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469003,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,380.08411,[M-H]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469004,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,380.08411,[M-H]-,60.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469005,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,380.08411,[M-H]-,30.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469006,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,380.08411,[M-H]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469007,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,426.08959,[M+FA]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469008,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,426.08959,[M+FA]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469009,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,426.08959,[M+FA]-,60.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469010,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,426.08959,[M+FA]-,15.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469011,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,426.08959,[M+FA]-,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469012,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,382.09867,[M+H]+,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469013,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,382.09867,[M+H]+,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469014,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,382.09867,[M+H]+,45.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469015,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,382.09867,[M+H]+,60.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469016,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O,382.09867,[M+H]+,20.0,val,CN1CCCn2cc(S(=O)(=O)NCCc3ccc(Cl)cc3)cc2C1=O
469017,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,428.06886,[M-H]-,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469018,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,428.06886,[M-H]-,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469019,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,428.06886,[M-H]-,60.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469020,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,428.06886,[M-H]-,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469021,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,428.06886,[M-H]-,45.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469022,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,430.08341,[M+H]+,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469023,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,430.08341,[M+H]+,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469024,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,430.08341,[M+H]+,60.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469025,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,430.08341,[M+H]+,30.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469026,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1,430.08341,[M+H]+,20.0,val,O=C1COc2cc(S(=O)(=O)N3CCCC3C(=O)N3CCOCC3)c(Cl)cc2N1
469027,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,20.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469028,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,20.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469029,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,60.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469030,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,15.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469031,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,20.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469032,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,60.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469033,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1,378.11498,[M+H]+,20.0,val,CCC1CN2C=NC(N3CCN(C(=O)c4ccc(Cl)s4)CC3)=CC2=N1
469034,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469035,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469036,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469037,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469038,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469039,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469040,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469041,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469042,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469043,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469044,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469045,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469046,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469047,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469048,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469049,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469050,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469051,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469052,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469053,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469054,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469055,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469056,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469057,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469058,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469059,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469060,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469061,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469062,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469063,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469064,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469065,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469066,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469067,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,363.10202,[M-H]-,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469068,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469069,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469070,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,60.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469071,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,30.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469072,CCCCNc1c(Oc2ccccc2)c(S(N)(=O)=O)cc(C(=O)O)c1,365.11657,[M+H]+,20.0,val,CCCCNc1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1
469073,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469074,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469075,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,60.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469076,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,30.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469077,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469078,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,60.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469079,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,30.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469080,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,363.10202,[M-H]-,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469081,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,365.11657,[M+H]+,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469082,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,365.11657,[M+H]+,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469083,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,365.11657,[M+H]+,60.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469084,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,365.11657,[M+H]+,15.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469085,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,365.11657,[M+H]+,20.0,val,O=C(CC1CCS(=O)(=O)C1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
469086,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,20.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469087,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,20.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469088,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,60.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469089,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,20.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469090,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,45.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469091,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,60.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469092,CCc1cc2c(C(=O)N3CCSCC3)cc(C)nc2cc1,301.13691,[M+H]+,20.0,val,CCc1ccc2nc(C)cc(C(=O)N3CCSCC3)c2c1
469093,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,299.12236,[M-H]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469094,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,299.12236,[M-H]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469095,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,299.12236,[M-H]-,15.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469096,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,299.12236,[M-H]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469097,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469098,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469099,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,60.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469100,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,15.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469101,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469102,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,15.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469103,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469104,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,345.12784,[M+FA]-,60.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469105,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,299.12236,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469106,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,299.12236,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469107,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,299.12236,[M-H]-,60.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469108,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,299.12236,[M-H]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469109,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,299.12236,[M-H]-,60.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469110,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,345.12784,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469111,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,345.12784,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469112,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,345.12784,[M+FA]-,60.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469113,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,345.12784,[M+FA]-,15.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469114,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,345.12784,[M+FA]-,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469115,COc1ccccc1CNC(=S)NCCc1ccccc1,299.12236,[M-H]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469116,COc1ccccc1CNC(=S)NCCc1ccccc1,299.12236,[M-H]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469117,COc1ccccc1CNC(=S)NCCc1ccccc1,299.12236,[M-H]-,60.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469118,COc1ccccc1CNC(=S)NCCc1ccccc1,299.12236,[M-H]-,15.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469119,COc1ccccc1CNC(=S)NCCc1ccccc1,299.12236,[M-H]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469120,COc1ccccc1CNC(=S)NCCc1ccccc1,345.12784,[M+FA]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469121,COc1ccccc1CNC(=S)NCCc1ccccc1,345.12784,[M+FA]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469122,COc1ccccc1CNC(=S)NCCc1ccccc1,345.12784,[M+FA]-,60.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469123,COc1ccccc1CNC(=S)NCCc1ccccc1,345.12784,[M+FA]-,15.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469124,COc1ccccc1CNC(=S)NCCc1ccccc1,345.12784,[M+FA]-,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469125,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469126,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469127,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,60.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469128,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,30.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469129,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469130,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,20.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469131,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,30.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469132,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1,301.13691,[M+H]+,60.0,val,O=C(NCC1(c2cccs2)CCCC1)Nc1ccccc1
469133,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469134,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469135,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,60.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469136,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,30.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469137,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469138,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,60.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469139,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,30.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469140,COc1ccccc1CNC(=S)NCCc1ccccc1,301.13691,[M+H]+,20.0,val,COc1ccccc1CNC(=S)NCCc1ccccc1
469141,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,20.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469142,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,20.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469143,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,45.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469144,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,60.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469145,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,20.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469146,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,45.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469147,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,60.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469148,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2,301.13691,[M+H]+,20.0,val,CCSc1nc(=O)n(CCc2ccccc2)c2c1CCC2
469149,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,20.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469150,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,20.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469151,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,60.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469152,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,20.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469153,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,60.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469154,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1,301.13691,[M+H]+,20.0,val,O=C(NC1CCCCCC1)c1ccc(-c2ccsc2)nc1
469155,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1
469156,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1
469157,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1,301.13691,[M+H]+,45.0,val,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1
469158,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1,301.13691,[M+H]+,60.0,val,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1
469159,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2ccc(C(=O)NC3CCCCC3)cc2)cs1
469160,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,20.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469161,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,20.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469162,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,60.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469163,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,30.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469164,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,20.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469165,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,60.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469166,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,30.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469167,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21,301.13691,[M+H]+,20.0,val,CN1CCCc2cc(CCNC(=O)c3cccs3)ccc21
469168,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469169,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469170,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,45.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469171,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,60.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469172,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469173,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469174,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,45.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469175,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1,301.13691,[M+H]+,60.0,val,Cc1nc(-c2cccc(NC(=O)C3CCCCC3)c2)cs1
469176,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,20.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469177,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,20.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469178,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,30.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469179,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,60.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469180,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,20.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469181,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,45.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469182,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,60.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469183,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1,301.13691,[M+H]+,20.0,val,CC(C)(C)c1ccc(SCC(=O)Nc2ccccn2)cc1
469184,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469185,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469186,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469187,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,30.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469188,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469189,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469190,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,30.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469191,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1,301.13691,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2cc3c(s2)N(C)CCC3)cc1
469192,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1,301.13691,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1
469193,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1,301.13691,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1
469194,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1,301.13691,[M+H]+,45.0,val,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1
469195,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1,301.13691,[M+H]+,60.0,val,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1
469196,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1,301.13691,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2nc3c(s2)CC(C)CC3)c1
469197,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,327.14627,[M-H]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469198,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,327.14627,[M-H]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469199,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,327.14627,[M-H]-,60.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469200,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,327.14627,[M-H]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469201,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,327.14627,[M-H]-,45.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469202,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,373.15174,[M+FA]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469203,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,373.15174,[M+FA]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469204,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,373.15174,[M+FA]-,60.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469205,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,373.15174,[M+FA]-,15.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469206,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,373.15174,[M+FA]-,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469207,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469208,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469209,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,60.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469210,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,30.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469211,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469212,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,45.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469213,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,60.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469214,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,327.14626,[M-H]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469215,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469216,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469217,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,363.12294,[M+Cl]-,15.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469218,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469219,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469220,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469221,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469222,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469223,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469224,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469225,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469226,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,327.14627,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469227,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,327.14627,[M-H]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469228,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,327.14627,[M-H]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469229,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,327.14627,[M-H]-,60.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469230,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,327.14627,[M-H]-,30.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469231,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,327.14627,[M-H]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469232,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469233,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469234,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,363.12294,[M+Cl]-,15.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469235,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,363.12294,[M+Cl]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469236,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,373.15174,[M+FA]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469237,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,373.15174,[M+FA]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469238,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,373.15174,[M+FA]-,60.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469239,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,373.15174,[M+FA]-,15.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469240,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,373.15174,[M+FA]-,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469241,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469242,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469243,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,60.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469244,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469245,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,45.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469246,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,60.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469247,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469248,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,327.14627,[M-H]-,45.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469249,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,327.14626,[M-H]-,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469250,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,327.14626,[M-H]-,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469251,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,327.14626,[M-H]-,60.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469252,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,327.14626,[M-H]-,30.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469253,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,327.14626,[M-H]-,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469254,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469255,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469256,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469257,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469258,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469259,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469260,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469261,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469262,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469263,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469264,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469265,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469266,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469267,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,60.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469268,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,30.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469269,COc1c(C(=O)Nc2n[nH]c(C3CC4CCC3C4)c2)c(=O)[nH]cc1,329.16082,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C(=O)Nc1cc(C2CC3CCC2C3)[nH]n1
469270,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469271,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469272,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,329.16082,[M+H]+,60.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469273,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,329.16082,[M+H]+,30.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469274,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(=O)nc(-c2ccc(NC(=O)CC3COCCN3)cc2)[nH]1
469275,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469276,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469277,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,30.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469278,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,60.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469279,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,15.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469280,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469281,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,60.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469282,COc1cccc(C(=O)NCC(=O)NC2CCc3c(C2)[nH]nc3)c1,329.16082,[M+H]+,20.0,val,COc1cccc(C(=O)NCC(=O)NC2CCc3cn[nH]c3C2)c1
469283,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1,329.16082,[M+H]+,20.0,val,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1
469284,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1,329.16082,[M+H]+,20.0,val,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1
469285,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1,329.16082,[M+H]+,60.0,val,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1
469286,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1,329.16082,[M+H]+,15.0,val,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1
469287,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1,329.16082,[M+H]+,20.0,val,NC(=O)C1(NC(=O)Cn2ncc3ccccc3c2=O)CCCCC1
469288,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469289,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469290,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469291,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469292,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469293,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469294,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469295,Cc1c(C(=O)N2CCOCC2)cc(NC(=O)c2cn(C)cn2)cc1,329.16082,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cn(C)cn2)cc1C(=O)N1CCOCC1
469296,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469297,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469298,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,60.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469299,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469300,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,60.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469301,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O,329.16082,[M+H]+,20.0,val,Cn1nc(-c2ccncc2)cc1C(=O)N1CCCCC1CC(=O)O
469302,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,329.16082,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469303,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,329.16082,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469304,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,329.16082,[M+H]+,60.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469305,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,329.16082,[M+H]+,30.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469306,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2c(nccc2)N1,329.16082,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCN(C(=O)C3CC3)CC2)c2cccnc2N1
469307,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469308,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469309,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,60.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469310,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469311,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,45.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469312,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,60.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469313,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469314,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1,329.16082,[M+H]+,45.0,val,COc1cccc(CCCN2C(=O)N[C@@H](Cc3cnc[nH]3)C2=O)c1
469315,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,20.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469316,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,20.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469317,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,30.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469318,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,60.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469319,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,15.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469320,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,20.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469321,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,60.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469322,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21,329.16082,[M+H]+,20.0,val,COCCN1C(=O)N[C@@H]2CN(C(=O)c3cccc(C#N)c3)CC[C@@H]21
469323,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,373.15174,[M+FA]-,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469324,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,373.15174,[M+FA]-,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469325,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,373.15174,[M+FA]-,60.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469326,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,373.15174,[M+FA]-,15.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469327,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,373.15174,[M+FA]-,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469328,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,327.14627,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469329,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,327.14627,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469330,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,327.14627,[M-H]-,60.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469331,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,327.14627,[M-H]-,30.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469332,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,327.14627,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469333,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,363.12294,[M+Cl]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469334,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469335,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469336,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,60.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469337,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,15.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469338,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469339,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,15.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469340,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469341,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,373.15174,[M+FA]-,60.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469342,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,327.14627,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469343,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,327.14627,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469344,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,327.14627,[M-H]-,45.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469345,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,327.14627,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469346,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,327.14627,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469347,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,327.14627,[M-H]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469348,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,327.14627,[M-H]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469349,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,327.14627,[M-H]-,60.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469350,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,327.14627,[M-H]-,30.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469351,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,327.14627,[M-H]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469352,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,363.12294,[M+Cl]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469353,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,363.12294,[M+Cl]-,60.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469354,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,363.12294,[M+Cl]-,15.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469355,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,363.12294,[M+Cl]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469356,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,373.15174,[M+FA]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469357,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,373.15174,[M+FA]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469358,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,373.15174,[M+FA]-,60.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469359,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,373.15174,[M+FA]-,15.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469360,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,373.15174,[M+FA]-,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469361,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,327.14627,[M-H]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469362,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,327.14627,[M-H]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469363,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,327.14627,[M-H]-,60.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469364,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,327.14627,[M-H]-,30.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469365,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,327.14627,[M-H]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469366,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,373.15174,[M+FA]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469367,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,373.15174,[M+FA]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469368,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,373.15174,[M+FA]-,60.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469369,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,373.15174,[M+FA]-,15.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469370,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,373.15174,[M+FA]-,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469371,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469372,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469373,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469374,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,30.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469375,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469376,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469377,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,30.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469378,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,327.14627,[M-H]-,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469379,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,363.12294,[M+Cl]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469380,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,363.12294,[M+Cl]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469381,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,363.12294,[M+Cl]-,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469382,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,363.12294,[M+Cl]-,15.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469383,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,363.12294,[M+Cl]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469384,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469385,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469386,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469387,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,15.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469388,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469389,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,15.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469390,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469391,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,373.15174,[M+FA]-,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469392,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,327.14626,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469393,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,327.14626,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469394,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,327.14626,[M-H]-,60.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469395,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,327.14626,[M-H]-,30.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469396,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,327.14626,[M-H]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469397,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469398,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469399,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,60.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469400,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,15.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469401,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469402,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,15.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469403,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,60.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469404,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,373.15174,[M+FA]-,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469405,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469406,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469407,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,60.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469408,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,30.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469409,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469410,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,60.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469411,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,30.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469412,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,329.16082,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469413,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,351.14276,[M+Na]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469414,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,351.14276,[M+Na]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469415,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,351.14276,[M+Na]+,45.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469416,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,351.14276,[M+Na]+,60.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469417,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O,351.14276,[M+Na]+,20.0,val,Cn1cccc(C(=O)N2CCC(COc3ncccn3)CC2)c1=O
469418,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2,329.16082,[M+H]+,20.0,val,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2
469419,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2,329.16082,[M+H]+,20.0,val,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2
469420,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2,329.16082,[M+H]+,60.0,val,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2
469421,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2,329.16082,[M+H]+,15.0,val,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2
469422,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2,329.16082,[M+H]+,20.0,val,CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCOC2
469423,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469424,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469425,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,60.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469426,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,30.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469427,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469428,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,30.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469429,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469430,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1,329.16082,[M+H]+,60.0,val,Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1
469431,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,20.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469432,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,20.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469433,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,60.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469434,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,30.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469435,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,20.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469436,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,20.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469437,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,60.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469438,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2,329.16082,[M+H]+,30.0,val,O=C(c1cccc(Cn2cncn2)c1)N1CCC2(CC1)OCCO2
469439,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469440,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469441,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,60.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469442,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,30.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469443,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469444,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,30.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469445,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,60.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469446,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,329.16082,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
469447,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469448,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469449,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,30.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469450,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,60.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469451,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,15.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469452,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469453,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,60.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469454,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1,329.16082,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCC(Oc2ccc(C)nn2)C1
469455,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469456,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469457,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469458,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,30.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469459,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469460,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469461,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,30.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469462,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,329.16082,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469463,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,351.14276,[M+Na]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469464,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,351.14276,[M+Na]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469465,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,351.14276,[M+Na]+,60.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469466,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,351.14276,[M+Na]+,30.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469467,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1,351.14276,[M+Na]+,20.0,val,O=C(Nc1ccc2c(c1)OCO2)N1CCC(Cn2cccn2)CC1
469468,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,20.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469469,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,20.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469470,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,60.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469471,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,30.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469472,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,20.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469473,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,20.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469474,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,60.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469475,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1,329.16082,[M+H]+,30.0,val,Cc1cccc(OC2CCN(C(=O)c3cc4n(n3)CCCO4)C2)n1
469476,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469477,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469478,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,60.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469479,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,15.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469480,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469481,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,15.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469482,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469483,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1,329.16082,[M+H]+,60.0,val,Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1
469484,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1,329.16082,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1
469485,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1,329.16082,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1
469486,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1,329.16082,[M+H]+,45.0,val,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1
469487,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1,329.16082,[M+H]+,60.0,val,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1
469488,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1,329.16082,[M+H]+,20.0,val,COc1cc(=O)n(C)cc1C(=O)N(C)C1CN(c2ccccn2)C1
469489,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469490,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469491,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,60.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469492,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,30.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469493,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469494,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,60.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469495,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,30.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469496,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1,329.16082,[M+H]+,20.0,val,COc1cccc(CNC(=O)c2cc(N3CCOCC3)ncn2)c1
469497,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469498,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469499,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,60.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469500,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,30.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469501,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469502,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,30.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469503,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,60.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469504,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1,329.16082,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OCO4)CC2)n[nH]1
469505,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469506,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469507,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,60.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469508,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,30.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469509,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469510,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,30.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469511,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,60.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469512,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1,329.16082,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)NCc2nccnc2-c2ccco2)CC1
469513,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469514,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469515,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,30.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469516,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,60.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469517,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,15.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469518,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469519,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,60.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469520,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2,329.16082,[M+H]+,20.0,val,Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2
469521,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469522,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469523,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,30.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469524,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,60.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469525,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,15.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469526,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469527,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,60.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469528,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C,329.16082,[M+H]+,20.0,val,COc1ccc(OC)c2c1cc(C(=O)NCCn1ccnc1)n2C
469529,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1,329.16082,[M+H]+,20.0,val,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1
469530,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1,329.16082,[M+H]+,20.0,val,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1
469531,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1,329.16082,[M+H]+,60.0,val,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1
469532,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1,329.16082,[M+H]+,30.0,val,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1
469533,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1,329.16082,[M+H]+,20.0,val,Cc1noc(CNC(=O)COc2cccc3c2ccn3C(C)C)n1
469534,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,329.16082,[M+H]+,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469535,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,329.16082,[M+H]+,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469536,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,329.16082,[M+H]+,60.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469537,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,329.16082,[M+H]+,30.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469538,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1,329.16082,[M+H]+,20.0,val,CCOC(=O)Cc1ccc(NC(=O)N2CCc3nc[nH]c3C2)cc1
469539,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469540,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469541,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,60.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469542,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,30.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469543,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469544,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,30.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469545,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,60.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469546,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1,329.16082,[M+H]+,20.0,val,Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)o1
469547,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,20.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469548,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,20.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469549,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,30.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469550,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,60.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469551,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,15.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469552,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,20.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469553,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,60.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469554,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1,329.16082,[M+H]+,20.0,val,COc1nccnc1OC1CCCN(C(=O)Cc2cccnc2)C1
469555,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469556,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469557,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469558,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469559,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469560,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469561,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469562,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1,329.16082,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cnccn2)cc1
469563,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469564,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469565,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469566,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,30.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469567,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469568,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469569,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,30.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469570,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,375.11325,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469571,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469572,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469573,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469574,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469575,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469576,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469577,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469578,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,375.11325,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469579,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469580,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469581,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469582,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,15.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469583,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469584,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469585,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,15.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469586,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccccc2)n1,377.1278,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
469587,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469588,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469589,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469590,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469591,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469592,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469593,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469594,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O,377.1278,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)O
469595,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,20.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469596,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,20.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469597,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,45.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469598,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,60.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469599,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,20.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469600,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,60.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469601,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,45.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469602,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N,345.12021,[M+H]+,20.0,val,CCn1c(SC(C)C)nnc1-c1cc(-c2ccccc2)sc1N
469603,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,417.13505,[M+FA]-,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469604,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,417.13505,[M+FA]-,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469605,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,417.13505,[M+FA]-,60.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469606,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,417.13505,[M+FA]-,15.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469607,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,417.13505,[M+FA]-,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469608,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,373.14412,[M+H]+,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469609,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,373.14412,[M+H]+,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469610,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,373.14412,[M+H]+,60.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469611,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,373.14412,[M+H]+,30.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469612,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1,373.14412,[M+H]+,20.0,val,O=C(CCc1nc(-c2cccs2)no1)N1CCC(Cn2ccnn2)CC1
469613,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,20.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469614,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,20.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469615,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,60.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469616,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,20.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469617,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,60.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469618,CC(C)(O)c1cc2c(s1)c(N1CCOCC1)nc(-c1cnc(N)nc1)n2,373.14412,[M+H]+,20.0,val,CC(C)(O)c1cc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1
469619,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,417.13505,[M+FA]-,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469620,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,417.13505,[M+FA]-,60.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469621,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,417.13505,[M+FA]-,15.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469622,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,417.13505,[M+FA]-,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469623,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469624,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469625,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,60.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469626,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469627,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,60.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469628,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1,373.14412,[M+H]+,20.0,val,CCn1cc(S(=O)(=O)N2CCCn3nc(-c4ccncc4)cc3C2)cn1
469629,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469630,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469631,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469632,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,30.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469633,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469634,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469635,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469636,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1,373.14412,[M+H]+,30.0,val,Cc1ccc(CNC(=O)c2nc(N3CCSCC3)c3cnn(C)c3n2)o1
469637,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,355.15241,[M-H]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469638,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,355.15241,[M-H]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469639,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,355.15241,[M-H]-,60.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469640,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,355.15241,[M-H]-,15.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469641,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,355.15241,[M-H]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469642,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,401.15789,[M+FA]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469643,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,401.15789,[M+FA]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469644,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,401.15789,[M+FA]-,60.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469645,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,401.15789,[M+FA]-,15.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469646,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,401.15789,[M+FA]-,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469647,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469648,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469649,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,60.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469650,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469651,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,45.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469652,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,60.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469653,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,20.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469654,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2cn3ccnc3cc2)n[nH]c1=O,357.16697,[M+H]+,45.0,val,CCn1c([C@@H]2C[C@H](OC)CN2C(=O)c2ccc3nccn3c2)n[nH]c1=O
469655,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1,357.16697,[M+H]+,20.0,val,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1
469656,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1,357.16697,[M+H]+,20.0,val,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1
469657,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1,357.16697,[M+H]+,60.0,val,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1
469658,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1,357.16697,[M+H]+,30.0,val,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1
469659,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1,357.16697,[M+H]+,20.0,val,COCc1noc(C2CCCCN2Cc2nc(-c3ccccn3)no2)n1
469660,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,20.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469661,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,20.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469662,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,60.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469663,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,20.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469664,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,20.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469665,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1,341.15429,[M+H]+,60.0,val,Cc1cc(N2CC3CN(c4nccs4)CC3C2)n2nc(C)cc2n1
469666,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469667,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469668,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,60.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469669,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,15.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469670,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469671,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,60.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469672,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,15.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469673,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,305.13835,[M+H]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469674,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,322.1649,[M+NH4]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469675,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,322.1649,[M+NH4]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469676,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,322.1649,[M+NH4]+,60.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469677,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,322.1649,[M+NH4]+,30.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469678,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,322.1649,[M+NH4]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469679,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,327.12029,[M+Na]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469680,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,327.12029,[M+Na]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469681,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,327.12029,[M+Na]+,30.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469682,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,327.12029,[M+Na]+,60.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469683,CC(=O)O[C@@H]1c2c(occ2C)C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C,327.12029,[M+Na]+,20.0,val,CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]23O[C@@H]2CC[C@H](C)[C@@]13C
469684,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O,305.13835,[M+H]+,20.0,val,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O
469685,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O,305.13835,[M+H]+,20.0,val,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O
469686,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O,305.13835,[M+H]+,60.0,val,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O
469687,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O,305.13835,[M+H]+,30.0,val,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O
469688,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O,305.13835,[M+H]+,20.0,val,COc1cc(CCc2cc(OC)c(O)c(OC)c2)ccc1O
469689,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469690,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469691,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469692,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469693,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,45.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469694,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469695,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469696,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,357.14315,[M-H]-,45.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469697,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,393.11983,[M+Cl]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469698,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,393.11983,[M+Cl]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469699,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,393.11983,[M+Cl]-,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469700,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,393.11983,[M+Cl]-,30.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469701,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,393.11983,[M+Cl]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469702,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469703,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469704,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469705,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,15.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469706,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469707,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469708,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,15.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469709,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,403.14863,[M+FA]-,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469710,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469711,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469712,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469713,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,30.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469714,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469715,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,60.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469716,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,30.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469717,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1,359.1577,[M+H]+,20.0,val,CC(=O)Nc1cc(C(=O)NC2CCC(CO)CC2)cc(C(F)(F)F)c1
469718,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,370.16166,[M]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469719,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,370.16166,[M]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469720,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,370.16166,[M]+,60.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469721,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,370.16166,[M]+,30.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469722,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,370.16166,[M]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469723,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469724,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469725,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,60.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469726,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,30.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469727,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469728,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,60.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469729,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,30.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469730,CN(C)c1cc(Cc2nnc(C(F)(F)F)o2)c(NC(=O)C(C)(C)C)cc1,371.16894,[M+H]+,20.0,val,CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1
469731,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,20.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469732,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,20.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469733,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,60.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469734,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,30.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469735,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,20.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469736,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,30.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469737,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,60.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469738,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1,371.16894,[M+H]+,20.0,val,CC(C)c1ocnc1CN1CCC(Oc2nccc(C(F)(F)F)n2)CC1
469739,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1,328.15904,[M+H]+,20.0,val,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1
469740,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1,328.15904,[M+H]+,20.0,val,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1
469741,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1,328.15904,[M+H]+,45.0,val,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1
469742,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1,328.15904,[M+H]+,60.0,val,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1
469743,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1,328.15904,[M+H]+,20.0,val,CN(C)c1cccc(-c2nn3c(C4CCCCC4)nnc3s2)c1
469744,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,20.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469745,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,20.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469746,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,60.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469747,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,30.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469748,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,20.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469749,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,20.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469750,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,30.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469751,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1,328.15904,[M+H]+,60.0,val,c1cnc(N2CC3CN(Cc4nc5c(s4)CCC5)CC3C2)nc1
469752,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1,328.15904,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1
469753,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1,328.15904,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1
469754,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1,328.15904,[M+H]+,60.0,val,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1
469755,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1,328.15904,[M+H]+,15.0,val,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1
469756,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1,328.15904,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCN(c3ncccn3)CC2)c1
469757,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,20.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469758,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,20.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469759,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,60.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469760,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,30.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469761,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,20.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469762,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,20.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469763,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,30.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469764,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1,328.15904,[M+H]+,60.0,val,c1ccc(-c2nnc3sc(CCN4CCCCCC4)nn23)cc1
469765,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,20.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469766,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,20.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469767,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,60.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469768,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,30.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469769,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,20.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469770,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,60.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469771,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,30.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469772,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1,328.15904,[M+H]+,20.0,val,c1ccc(CCc2nn3c(CN4CCCCC4)nnc3s2)cc1
469773,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469774,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469775,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,60.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469776,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,15.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469777,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469778,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,60.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469779,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469780,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1,404.14993,[M+H]+,15.0,val,Cn1cc(-c2cnc(OC3CCN(S(=O)(=O)c4nccn4C)CC3)nc2)cn1
469781,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,364.12242,[M+FA]-,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469782,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,364.12242,[M+FA]-,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469783,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,364.12242,[M+FA]-,60.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469784,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,364.12242,[M+FA]-,15.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469785,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,364.12242,[M+FA]-,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469786,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469787,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469788,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,60.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469789,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,30.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469790,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469791,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,30.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469792,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469793,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,318.11694,[M-H]-,60.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469794,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,354.09362,[M+Cl]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469795,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,354.09362,[M+Cl]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469796,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,354.09362,[M+Cl]-,15.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469797,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,354.09362,[M+Cl]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469798,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,364.12242,[M+FA]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469799,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,364.12242,[M+FA]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469800,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,364.12242,[M+FA]-,60.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469801,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,364.12242,[M+FA]-,15.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469802,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1,364.12242,[M+FA]-,20.0,val,Cc1cccc(CS(=O)(=O)NCC(O)Cc2ccccc2)c1
469803,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469804,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469805,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469806,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469807,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469808,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469809,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469810,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12,320.13149,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N2CCCC(C)C2)c2ccccc12
469811,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469812,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469813,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,15.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469814,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,60.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469815,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,30.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469816,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469817,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,20.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469818,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1,302.12093,[M+H-H2O]+,60.0,val,CC(C)c1ccc(OCC(=O)NCC(O)c2cccs2)cc1
469819,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,20.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469820,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,20.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469821,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,60.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469822,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,30.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469823,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,20.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469824,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,60.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469825,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,30.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469826,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1,320.13149,[M+H]+,20.0,val,COc1ccc2cc(S(=O)(=O)N3CCCCC3C)ccc2c1
469827,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469828,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469829,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,45.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469830,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469831,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469832,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,45.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469833,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469834,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1,320.13149,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(CCC(=O)N2C3C=CCC2CC3)cc1
469835,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,20.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469836,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,20.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469837,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,60.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469838,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,30.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469839,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,20.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469840,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,60.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469841,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,20.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469842,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1,320.13149,[M+H]+,30.0,val,COc1ccc(OCC(=O)NCC(C)(C)c2ccsc2)cc1
469843,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,320.13149,[M+H]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469844,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,320.13149,[M+H]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469845,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,320.13149,[M+H]+,60.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469846,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,320.13149,[M+H]+,15.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469847,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,320.13149,[M+H]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469848,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,342.11343,[M+Na]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469849,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,342.11343,[M+Na]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469850,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,342.11343,[M+Na]+,45.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469851,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,342.11343,[M+Na]+,60.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469852,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1,342.11343,[M+Na]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)c3ccco3)CCCC2)s1
469853,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1,320.13149,[M+H]+,20.0,val,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1
469854,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1,320.13149,[M+H]+,20.0,val,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1
469855,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1,320.13149,[M+H]+,60.0,val,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1
469856,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1,320.13149,[M+H]+,30.0,val,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1
469857,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1,320.13149,[M+H]+,20.0,val,COC(CNC(=O)C(C)Oc1ccccc1)c1ccc(C)s1
469858,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469859,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469860,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,60.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469861,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,15.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469862,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469863,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,60.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469864,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,15.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469865,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1,302.12093,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccco1)C1(c2cccs2)CCCC1
469866,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,20.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469867,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,20.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469868,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,60.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469869,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,15.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469870,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,20.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469871,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,20.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469872,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,15.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469873,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1,320.13149,[M+H]+,60.0,val,O=C(CSC1CCCC1)NCC(c1ccco1)c1ccco1
469874,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,350.12769,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469875,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,350.12769,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469876,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,350.12769,[M-H]-,60.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469877,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,350.12769,[M-H]-,15.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469878,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,350.12769,[M-H]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469879,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,386.10437,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469880,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,386.10437,[M+Cl]-,60.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469881,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,386.10437,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469882,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,386.10437,[M+Cl]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469883,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469884,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469885,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,60.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469886,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,15.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469887,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469888,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,60.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469889,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,15.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469890,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,396.13317,[M+FA]-,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469891,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,352.14225,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469892,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,352.14225,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469893,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,352.14225,[M+H]+,60.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469894,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,352.14225,[M+H]+,30.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469895,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1,352.14225,[M+H]+,20.0,val,NC(=O)C1CN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCO1
469896,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,20.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469897,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,20.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469898,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,60.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469899,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,30.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469900,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,20.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469901,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,60.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469902,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,30.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469903,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1,340.13101,[M+H]+,20.0,val,CCOC(=O)C1CCN(C(=O)C(C)Oc2cccc(Cl)c2)CC1
469904,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,392.13581,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469905,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,392.13581,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469906,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,392.13581,[M+Cl]-,15.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469907,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,392.13581,[M+Cl]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469908,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469909,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469910,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469911,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,15.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469912,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469913,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469914,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,15.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469915,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,402.16461,[M+FA]-,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469916,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469917,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469918,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469919,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469920,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469921,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,60.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469922,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,30.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469923,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O,358.17369,[M+H]+,20.0,val,O=C(NCC1CCN(CC(F)(F)F)C1)NC1c2ccccc2CC1O
469924,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469925,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469926,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469927,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469928,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469929,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469930,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,45.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469931,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,382.12423,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469932,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,418.10091,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469933,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,418.10091,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469934,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,418.10091,[M+Cl]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469935,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,418.10091,[M+Cl]-,15.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469936,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,418.10091,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469937,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469938,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469939,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469940,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469941,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469942,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469943,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469944,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F,384.13878,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F
469945,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469946,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469947,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469948,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469949,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469950,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469951,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469952,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469953,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469954,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469955,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469956,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469957,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469958,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469959,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469960,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469961,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469962,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469963,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469964,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469965,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469966,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469967,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469968,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,60.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469969,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,30.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469970,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1,303.15256,[M+H]+,20.0,val,CCCCCOc1ccccc1/C(=C\SC)n1ccnc1
469971,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,30.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469972,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,30.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469973,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,20.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469974,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,60.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469975,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,30.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469976,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,303.15256,[M+H]+,20.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469977,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,303.15256,[M+H]+,20.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469978,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,303.15256,[M+H]+,60.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469979,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,303.15256,[M+H]+,30.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469980,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,303.15256,[M+H]+,20.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469981,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,325.1345,[M+Na]+,30.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469982,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,325.1345,[M+Na]+,20.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469983,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1,325.1345,[M+Na]+,30.0,val,CN(Cc1csc(-c2ccccc2)n1)CC1CCCCO1
469984,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,20.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469985,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,20.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469986,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,60.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469987,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,30.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469988,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1,303.15256,[M+H]+,20.0,val,CCSc1nc2ccccc2c(=O)n1C1CCC(C)CC1
469989,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1,303.15256,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1
469990,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1,303.15256,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1
469991,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1,303.15256,[M+H]+,60.0,val,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1
469992,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1,303.15256,[M+H]+,30.0,val,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1
469993,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1,303.15256,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(NCc2ccc(C)s2)cc1
469994,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
469995,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
469996,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,60.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
469997,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,15.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
469998,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
469999,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,60.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
470000,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,20.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
470001,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C,303.15256,[M+H]+,15.0,val,Cc1ccc(C(=O)NCC(c2ccsc2)N(C)C)cc1C
470002,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470003,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470004,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,60.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470005,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,30.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470006,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470007,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,30.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470008,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,60.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470009,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1,303.15256,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC(=S)NCCC1=CCCCC1
470010,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,20.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470011,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,20.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470012,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,30.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470013,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,60.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470014,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,15.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470015,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,20.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470016,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,20.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470017,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,30.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470018,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21,303.15256,[M+H]+,60.0,val,Cn1cc(SCC(=O)NC2CCCCC2)c2ccccc21
470019,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1,303.15256,[M+H]+,20.0,val,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1
470020,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1,303.15256,[M+H]+,20.0,val,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1
470021,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1,303.15256,[M+H]+,15.0,val,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1
470022,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1,303.15256,[M+H]+,60.0,val,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1
470023,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1,303.15256,[M+H]+,20.0,val,Cc1ccc(CNc2cccc(NC(=O)CC(C)C)c2)s1
470024,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470025,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470026,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,60.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470027,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470028,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,45.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470029,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,60.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470030,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470031,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,329.14416,[M-H]-,45.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470032,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,20.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470033,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,20.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470034,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,60.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470035,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,30.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470036,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,20.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470037,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,60.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470038,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,30.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470039,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1,331.15871,[M+H]+,20.0,val,CCN1CCC(CNC(=O)c2nc(-c3ccccc3)ns2)CC1
470040,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,20.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470041,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,20.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470042,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,30.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470043,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,60.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470044,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,15.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470045,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,20.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470046,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,60.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470047,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1,331.15871,[M+H]+,20.0,val,CNc1nc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cs1
470048,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470049,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470050,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,60.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470051,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,15.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470052,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470053,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,60.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470054,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,15.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470055,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1cc(C)cc(-c2nnc(NC(=O)CCC3CCNC3)s2)c1
470056,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1,331.15871,[M+H]+,20.0,val,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1
470057,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1,331.15871,[M+H]+,20.0,val,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1
470058,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1,331.15871,[M+H]+,60.0,val,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1
470059,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1,331.15871,[M+H]+,30.0,val,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1
470060,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1,331.15871,[M+H]+,20.0,val,CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc(N(C)C)s1
470061,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470062,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470063,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,60.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470064,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,30.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470065,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470066,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,60.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470067,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,30.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470068,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1,331.15871,[M+H]+,20.0,val,O=C(Cc1cccs1)N1CCCCC1c1nncn1CC1CC1
470069,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470070,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470071,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,45.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470072,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,60.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470073,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470074,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470075,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,45.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470076,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,329.14416,[M-H]-,60.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470077,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470078,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470079,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,45.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470080,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,60.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470081,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470082,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470083,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,45.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470084,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,329.14416,[M-H]-,60.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470085,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470086,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470087,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,60.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470088,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,15.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470089,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470090,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,15.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470091,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470092,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1,331.15871,[M+H]+,60.0,val,Cc1cnccc1OCC1CCN(c2nc(C3CC3)ns2)CC1
470093,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470094,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470095,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,45.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470096,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,60.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470097,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470098,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,45.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470099,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,60.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470100,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1,331.15871,[M+H]+,20.0,val,Cc1ccnc(Nc2nc(C)c(C(=O)N3CCC(C)CC3)s2)c1
470101,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470102,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470103,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,60.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470104,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,30.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470105,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470106,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,45.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470107,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,60.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470108,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2,331.15871,[M+H]+,20.0,val,CCCCCCSc1nnc2c(n1)OC(C)Nc1ccccc1-2
470109,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,20.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470110,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,20.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470111,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,30.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470112,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,60.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470113,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,20.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470114,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,45.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470115,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,20.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470116,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12,331.15871,[M+H]+,60.0,val,CC(C)c1nnc2sc(COc3ccc(C(C)(C)C)cc3)nn12
470117,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470118,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470119,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,60.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470120,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,30.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470121,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470122,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,20.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470123,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,30.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470124,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O,331.15871,[M+H]+,60.0,val,Cc1ccccc1Cc1n[nH]c(SCCN2CCCC2)nc1=O
470125,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,407.12171,[M+FA]-,30.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470126,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,407.12171,[M+FA]-,20.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470127,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,407.12171,[M+FA]-,60.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470128,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,20.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470129,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,20.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470130,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,60.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470131,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,15.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470132,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,20.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470133,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,60.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470134,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,15.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470135,Nc1c2c3c(CCCC3)sc2nc(SCC(=O)N2CCCCC2)n1,363.13078,[M+H]+,20.0,val,Nc1nc(SCC(=O)N2CCCCC2)nc2sc3c(c12)CCCC3
470136,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,305.13945,[M-H]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470137,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,305.13945,[M-H]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470138,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,305.13945,[M-H]-,60.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470139,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,305.13945,[M-H]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470140,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,305.13945,[M-H]-,45.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470141,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,351.14493,[M+FA]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470142,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,351.14493,[M+FA]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470143,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,351.14493,[M+FA]-,60.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470144,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,351.14493,[M+FA]-,15.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470145,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13,351.14493,[M+FA]-,20.0,val,CC1(CCC(=O)O)C(=O)C=CC23CC4CC(OC4(C)C2O)C13
470146,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,324.18055,[M+NH4]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470147,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,324.18055,[M+NH4]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470148,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,324.18055,[M+NH4]+,60.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470149,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,324.18055,[M+NH4]+,15.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470150,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,324.18055,[M+NH4]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470151,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,329.13594,[M+Na]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470152,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12,329.13594,[M+Na]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(COC(C)=O)CCC=C(CO)CC[C@@H]12
470153,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,307.154,[M+H]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470154,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,307.154,[M+H]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470155,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,307.154,[M+H]+,60.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470156,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,307.154,[M+H]+,30.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470157,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,307.154,[M+H]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470158,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,324.18055,[M+NH4]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470159,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,324.18055,[M+NH4]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470160,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,324.18055,[M+NH4]+,60.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470161,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,324.18055,[M+NH4]+,15.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470162,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12,324.18055,[M+NH4]+,20.0,val,C=C1CCC(OC(C)=O)C2(C)CC3(O)OC(=O)C(C)=C3CC12
470163,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,469.06756,[M+Cl]-,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470164,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,469.06756,[M+Cl]-,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470165,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,469.06756,[M+Cl]-,60.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470166,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,469.06756,[M+Cl]-,30.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470167,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,469.06756,[M+Cl]-,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470168,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,479.09636,[M+FA]-,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470169,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,479.09636,[M+FA]-,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470170,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,479.09636,[M+FA]-,60.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470171,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,479.09636,[M+FA]-,15.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470172,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,435.10543,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470173,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,435.10543,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470174,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,435.10543,[M+H]+,60.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470175,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,435.10543,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470176,O=C(NCCN1CCOCC1)c1c(F)ccc(S(=O)(=O)C2CCS(=O)(=O)C2)c1,435.10543,[M+H]+,45.0,val,O=C(NCCN1CCOCC1)c1cc(S(=O)(=O)C2CCS(=O)(=O)C2)ccc1F
470177,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470178,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470179,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,60.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470180,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470181,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,45.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470182,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,60.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470183,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,20.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470184,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21,286.19139,[M+H]+,45.0,val,O=C(NC1CN2CCC1CC2)C1CCNc2ccccc21
470185,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470186,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470187,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,15.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470188,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,60.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470189,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,30.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470190,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470191,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,60.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470192,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470193,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470194,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470195,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,30.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470196,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,60.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470197,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,15.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470198,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470199,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,60.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470200,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,286.19139,[M+H]+,20.0,val,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
470201,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,346.17723,[M+FA]-,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470202,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,346.17723,[M+FA]-,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470203,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,346.17723,[M+FA]-,60.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470204,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,346.17723,[M+FA]-,15.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470205,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,346.17723,[M+FA]-,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470206,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,300.17175,[M-H]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470207,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,300.17175,[M-H]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470208,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,300.17175,[M-H]-,60.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470209,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,300.17175,[M-H]-,15.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470210,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,300.17175,[M-H]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470211,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,336.14843,[M+Cl]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470212,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,336.14843,[M+Cl]-,15.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470213,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470214,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470215,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,60.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470216,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,15.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470217,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470218,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,60.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470219,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,15.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470220,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,346.17723,[M+FA]-,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470221,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,300.17175,[M-H]-,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470222,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,300.17175,[M-H]-,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470223,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,300.17175,[M-H]-,60.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470224,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,300.17175,[M-H]-,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470225,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,300.17175,[M-H]-,45.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470226,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470227,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470228,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,60.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470229,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,30.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470230,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470231,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,60.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470232,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,30.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470233,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,300.17175,[M-H]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470234,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,346.17723,[M+FA]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470235,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,346.17723,[M+FA]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470236,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,346.17723,[M+FA]-,60.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470237,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,346.17723,[M+FA]-,15.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470238,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,346.17723,[M+FA]-,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470239,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,300.17175,[M-H]-,30.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470240,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,300.17175,[M-H]-,20.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470241,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,300.17175,[M-H]-,30.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470242,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470243,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470244,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,60.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470245,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,30.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470246,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470247,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,60.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470248,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,30.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470249,CCOc1ccc(N(CC)C(=O)c2c(C)n(C)nc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(N(CC)C(=O)c2c(C)nn(C)c2C)cc1
470250,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,302.1863,[M+H]+,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470251,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,302.1863,[M+H]+,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470252,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,302.1863,[M+H]+,60.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470253,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,302.1863,[M+H]+,30.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470254,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1,302.1863,[M+H]+,20.0,val,O=C(Nc1ccncc1)C1CCCCC1C(=O)N1CCCC1
470255,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,302.1863,[M+H]+,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470256,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,302.1863,[M+H]+,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470257,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,302.1863,[M+H]+,60.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470258,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,302.1863,[M+H]+,15.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470259,CCc1c(NC(=O)NC(C)c2cc(C)cc(C)c2)c(C)no1,302.1863,[M+H]+,20.0,val,CCc1onc(C)c1NC(=O)NC(C)c1cc(C)cc(C)c1
470260,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,20.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470261,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,20.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470262,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,60.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470263,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,15.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470264,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,20.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470265,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,60.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470266,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,15.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470267,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1,302.1863,[M+H]+,20.0,val,O=C1CCN(CC(=O)NC2CCCc3ccccc32)CCN1
470268,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,302.1863,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470269,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,302.1863,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470270,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,302.1863,[M+H]+,60.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470271,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,302.1863,[M+H]+,15.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470272,Cc1c2c(CCNC(=O)NC3CCOCC3)c[nH]c2ccc1,302.1863,[M+H]+,20.0,val,Cc1cccc2[nH]cc(CCNC(=O)NC3CCOCC3)c12
470273,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1
470274,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1
470275,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1,302.1863,[M+H]+,60.0,val,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1
470276,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1,302.1863,[M+H]+,15.0,val,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1
470277,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(c2nc(-c3ccc(C)cc3)no2)CC1
470278,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,302.1863,[M+H]+,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470279,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,302.1863,[M+H]+,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470280,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,302.1863,[M+H]+,60.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470281,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,302.1863,[M+H]+,15.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470282,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21,302.1863,[M+H]+,20.0,val,CC1(C)CCC(NC(=O)N2CCNC(=O)C2)c2ccccc21
470283,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,20.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470284,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,20.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470285,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,60.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470286,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,30.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470287,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,20.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470288,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,60.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470289,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,30.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470290,CCc1c(C(=O)NC2CCN(C(=O)C3CC3)CC2)nccc1,302.1863,[M+H]+,20.0,val,CCc1cccnc1C(=O)NC1CCN(C(=O)C2CC2)CC1
470291,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470292,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470293,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,60.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470294,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,30.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470295,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470296,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,60.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470297,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,30.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470298,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1,302.1863,[M+H]+,20.0,val,CCC1(CO)CCN(C(=O)Cn2cc3ccccc3n2)CC1
470299,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,302.1863,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470300,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,302.1863,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470301,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,302.1863,[M+H]+,60.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470302,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,302.1863,[M+H]+,30.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470303,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1,302.1863,[M+H]+,20.0,val,CNC(=O)Cc1ccc(NC(=O)N2CCCC2C2CC2)cc1
470304,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470305,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470306,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,60.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470307,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,30.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470308,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470309,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470310,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470311,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,60.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470312,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,30.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470313,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470314,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470315,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470316,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470317,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470318,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470319,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470320,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470321,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470322,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470323,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470324,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,45.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470325,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,60.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470326,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470327,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,45.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470328,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470329,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,300.17175,[M-H]-,60.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470330,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,336.14843,[M+Cl]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470331,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,336.14843,[M+Cl]-,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470332,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,336.14843,[M+Cl]-,60.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470333,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,300.17175,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470334,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,300.17175,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470335,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,300.17175,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470336,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,300.17175,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470337,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,300.17175,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470338,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,336.14843,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470339,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,300.17175,[M-H]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470340,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,300.17175,[M-H]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470341,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,300.17175,[M-H]-,60.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470342,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,300.17175,[M-H]-,30.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470343,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,300.17175,[M-H]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470344,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470345,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470346,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,15.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470347,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,60.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470348,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470349,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470350,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,346.17723,[M+FA]-,60.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470351,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470352,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470353,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,60.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470354,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,30.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470355,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,300.17175,[M-H]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470356,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,346.17723,[M+FA]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470357,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,346.17723,[M+FA]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470358,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,346.17723,[M+FA]-,60.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470359,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,346.17723,[M+FA]-,30.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470360,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,346.17723,[M+FA]-,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470361,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470362,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470363,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,45.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470364,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,60.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470365,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470366,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470367,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,45.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470368,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,300.17175,[M-H]-,60.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470369,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,336.14843,[M+Cl]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470370,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,336.14843,[M+Cl]-,15.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470371,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,336.14843,[M+Cl]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470372,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,346.17723,[M+FA]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470373,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,346.17723,[M+FA]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470374,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,346.17723,[M+FA]-,60.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470375,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,346.17723,[M+FA]-,15.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470376,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,346.17723,[M+FA]-,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470377,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470378,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470379,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,15.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470380,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470381,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,30.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470382,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470383,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470384,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1,302.1863,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC(c2nc3ccccc3[nH]2)C1
470385,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,20.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470386,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,20.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470387,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,60.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470388,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,30.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470389,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,20.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470390,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,20.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470391,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,60.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470392,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1,302.1863,[M+H]+,30.0,val,CCN(CC)CCCNC(=O)c1cc(-c2ccccc2)on1
470393,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,20.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470394,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,20.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470395,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,60.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470396,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,30.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470397,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,20.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470398,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,30.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470399,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,20.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470400,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C,302.1863,[M+H]+,60.0,val,COc1ccc(C(C)(C)C)cc1NC(=O)c1cnn(C)c1C
470401,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,20.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470402,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,20.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470403,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,60.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470404,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,30.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470405,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,20.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470406,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,30.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470407,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,20.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470408,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1,302.1863,[M+H]+,60.0,val,CCCc1ccc(C(=O)N2CC(N3CCNC(=O)C3)C2)cc1
470409,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,20.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470410,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,20.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470411,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,60.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470412,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,15.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470413,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,20.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470414,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,15.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470415,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,20.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470416,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21,302.1863,[M+H]+,60.0,val,Cn1c(C2CCN(C(=O)OC(C)(C)C)C2)nc2ccccc21
470417,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1,302.1863,[M+H]+,20.0,val,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1
470418,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1,302.1863,[M+H]+,20.0,val,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1
470419,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1,302.1863,[M+H]+,45.0,val,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1
470420,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1,302.1863,[M+H]+,60.0,val,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1
470421,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1,302.1863,[M+H]+,20.0,val,c1ccc2oc(N3CCN(CC4CCCOC4)CC3)nc2c1
470422,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,20.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470423,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,20.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470424,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,60.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470425,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,30.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470426,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,20.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470427,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,45.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470428,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,20.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470429,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1,302.1863,[M+H]+,60.0,val,CCOCC(=O)N1CC(n2c(C(C)C)nc3ccccc32)C1
470430,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470431,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470432,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,60.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470433,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,30.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470434,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470435,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,20.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470436,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,30.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470437,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1,302.1863,[M+H]+,60.0,val,CCCCC(=O)N/N=C(\C)c1cccc(NC(=O)C2CC2)c1
470438,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,284.17574,[M+H-H2O]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470439,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,284.17574,[M+H-H2O]+,60.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470440,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,284.17574,[M+H-H2O]+,30.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470441,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,284.17574,[M+H-H2O]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470442,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470443,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470444,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,60.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470445,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,30.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470446,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470447,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,30.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470448,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,20.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470449,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,302.1863,[M+H]+,60.0,val,CCCC(C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
470450,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470451,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470452,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,45.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470453,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,60.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470454,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470455,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,45.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470456,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,60.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470457,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1,302.1863,[M+H]+,20.0,val,CCCCCOc1ccc(C(=O)Nc2cc(C)nn2C)cc1
470458,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470459,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470460,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470461,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470462,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470463,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,60.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470464,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,30.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470465,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1,302.1863,[M+H]+,20.0,val,Cc1ccc(C(=O)N2CCN(C(=O)CN3CCCC3)C2)cc1
470466,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,20.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470467,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,20.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470468,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,60.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470469,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,30.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470470,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,20.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470471,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,20.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470472,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,30.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470473,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1,302.1863,[M+H]+,60.0,val,N#Cc1ccnc(OCC2CCCN(CC3CCCO3)C2)c1
470474,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470475,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470476,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,60.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470477,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,30.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470478,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12,302.1863,[M+H]+,20.0,val,CCCC(CCC)C(=O)NCc1n[nH]c(=O)c2ccccc12
470479,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470480,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470481,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470482,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,30.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470483,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470484,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,20.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470485,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,30.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470486,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1,302.1863,[M+H]+,60.0,val,CCOc1ccc(NC(=O)CC(C)n2nc(C)cc2C)cc1
470487,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470488,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470489,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,60.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470490,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,30.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470491,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470492,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,30.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470493,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,20.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470494,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1,302.1863,[M+H]+,60.0,val,COc1ccc(NC(=O)NCC#CCN2CCCCC2)cc1
470495,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,360.14997,[M-H]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470496,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,360.14997,[M-H]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470497,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,360.14997,[M-H]-,60.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470498,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,360.14997,[M-H]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470499,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,360.14997,[M-H]-,45.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470500,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,396.12665,[M+Cl]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470501,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,396.12665,[M+Cl]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470502,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,396.12665,[M+Cl]-,60.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470503,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,396.12665,[M+Cl]-,15.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470504,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,406.15545,[M+FA]-,15.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470505,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,406.15545,[M+FA]-,15.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470506,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,406.15545,[M+FA]-,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470507,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,406.15545,[M+FA]-,60.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470508,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,406.15545,[M+FA]-,15.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470509,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,396.12665,[M+Cl]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470510,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,396.12665,[M+Cl]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470511,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,396.12665,[M+Cl]-,15.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470512,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,396.12665,[M+Cl]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470513,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470514,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470515,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,60.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470516,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,15.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470517,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470518,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,60.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470519,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,15.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470520,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,406.15545,[M+FA]-,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470521,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,20.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470522,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,20.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470523,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,60.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470524,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,15.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470525,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,20.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470526,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,45.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470527,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,60.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470528,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1,362.16452,[M+H]+,20.0,val,CCc1csc(-n2cc(C(=O)N3CCC4OCCN(C)C4C3)cn2)n1
470529,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,362.16452,[M+H]+,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470530,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,362.16452,[M+H]+,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470531,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,362.16452,[M+H]+,60.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470532,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,362.16452,[M+H]+,20.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470533,O=C(CC1CCN(c2nnc(-c3nocc3)s2)CC1)NC1CCCC1,362.16452,[M+H]+,45.0,val,O=C(CC1CCN(c2nnc(-c3ccon3)s2)CC1)NC1CCCC1
470534,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,362.16452,[M+H]+,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470535,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,362.16452,[M+H]+,20.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470536,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,362.16452,[M+H]+,60.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470537,Cc1nc(-c2ccccn2)cc(NC2CCCC2CNS(C)(=O)=O)n1,362.16452,[M+H]+,60.0,val,Cc1nc(NC2CCCC2CNS(C)(=O)=O)cc(-c2ccccn2)n1
470538,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,360.14997,[M-H]-,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470539,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,360.14997,[M-H]-,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470540,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,360.14997,[M-H]-,60.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470541,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,360.14997,[M-H]-,15.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470542,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,360.14997,[M-H]-,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470543,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,362.16452,[M+H]+,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470544,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,362.16452,[M+H]+,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470545,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,362.16452,[M+H]+,60.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470546,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,362.16452,[M+H]+,30.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470547,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1,362.16452,[M+H]+,20.0,val,CC(=O)N(c1nc(C)c(C(=O)NCCc2cnc[nH]2)s1)C1CCCC1
470548,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,392.1398,[M-H]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470549,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,392.1398,[M-H]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470550,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,392.1398,[M-H]-,60.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470551,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,392.1398,[M-H]-,30.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470552,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,392.1398,[M-H]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470553,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,438.14528,[M+FA]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470554,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,438.14528,[M+FA]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470555,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,438.14528,[M+FA]-,60.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470556,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,438.14528,[M+FA]-,15.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470557,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,438.14528,[M+FA]-,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470558,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,394.15435,[M+H]+,30.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470559,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,394.15435,[M+H]+,30.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470560,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,394.15435,[M+H]+,20.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470561,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,394.15435,[M+H]+,60.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470562,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O,394.15435,[M+H]+,30.0,val,CC1N=C(C(=O)NCCN2CCS(=O)(=O)CC2)NN(c2ccccc2)C1=O
470563,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,390.16053,[M+FA]-,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470564,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,390.16053,[M+FA]-,60.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470565,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,390.16053,[M+FA]-,15.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470566,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,390.16053,[M+FA]-,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470567,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470568,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470569,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,60.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470570,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,30.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470571,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470572,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,60.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470573,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,30.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470574,O=C(NC1CCCCC1)N1CCN(c2c3ccsc3ncn2)CC1,346.16961,[M+H]+,20.0,val,O=C(NC1CCCCC1)N1CCN(c2ncnc3sccc23)CC1
470575,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470576,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,15.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470577,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,60.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470578,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,30.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470579,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470580,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,60.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470581,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470582,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470583,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470584,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,60.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470585,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,30.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470586,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470587,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,30.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470588,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470589,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,344.15506,[M-H]-,60.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470590,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,380.13173,[M+Cl]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470591,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,380.13173,[M+Cl]-,15.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470592,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,380.13173,[M+Cl]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470593,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,390.16053,[M+FA]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470594,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,390.16053,[M+FA]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470595,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,390.16053,[M+FA]-,60.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470596,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,390.16053,[M+FA]-,15.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470597,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,390.16053,[M+FA]-,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470598,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470599,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470600,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470601,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,15.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470602,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470603,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470604,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,15.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470605,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,344.15506,[M-H]-,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470606,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,380.13173,[M+Cl]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470607,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,380.13173,[M+Cl]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470608,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,380.13173,[M+Cl]-,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470609,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,380.13173,[M+Cl]-,15.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470610,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,380.13173,[M+Cl]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470611,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,390.16053,[M+FA]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470612,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,390.16053,[M+FA]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470613,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,390.16053,[M+FA]-,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470614,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,390.16053,[M+FA]-,15.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470615,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,390.16053,[M+FA]-,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470616,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470617,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470618,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,15.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470619,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470620,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,30.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470621,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470622,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,60.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470623,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1,346.16961,[M+H]+,20.0,val,CCCc1nnsc1C(=O)NCC1CCN(c2ccncc2)CC1
470624,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470625,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470626,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,45.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470627,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,60.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470628,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470629,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470630,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,45.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470631,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,60.0,val,CC1CCCCC1NC(=O)CSc1nnc(-c2ccccc2)n1N
470632,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,20.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470633,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,20.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470634,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,45.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470635,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,60.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470636,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,20.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470637,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,45.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470638,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,60.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470639,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21,346.16961,[M+H]+,20.0,val,Cn1c(N2CCCC(C(=O)N3CCSCC3)C2)nc2cccnc21
470640,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470641,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470642,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,15.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470643,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,60.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470644,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,30.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470645,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470646,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,20.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470647,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,60.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470648,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1,346.16961,[M+H]+,30.0,val,CCC(Oc1ccccc1)c1nn2c(CN(CC)CC)nnc2s1
470649,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470650,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470651,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,45.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470652,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,60.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470653,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470654,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,45.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470655,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,60.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470656,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N,346.16961,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)CSc1nnc(-c2ccccc2)n1N
470657,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1,346.16961,[M+H]+,20.0,val,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1
470658,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1,346.16961,[M+H]+,20.0,val,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1
470659,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1,346.16961,[M+H]+,60.0,val,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1
470660,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1,346.16961,[M+H]+,30.0,val,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1
470661,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1,346.16961,[M+H]+,20.0,val,Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCCC3)ncn2)n1
470662,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470663,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470664,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,45.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470665,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,60.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470666,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470667,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,60.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470668,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,45.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470669,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1,346.16961,[M+H]+,20.0,val,Cc1cnc(N(C)C2CCCN(C(=O)c3sc(C)nc3C)C2)nc1
470670,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1,346.16961,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1
470671,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1,346.16961,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1
470672,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1,346.16961,[M+H]+,60.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1
470673,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1,346.16961,[M+H]+,30.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1
470674,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1,346.16961,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)c2cscn2)nn1
470675,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470676,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470677,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470678,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470679,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470680,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470681,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470682,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470683,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470684,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470685,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470686,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470687,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470688,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470689,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470690,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470691,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470692,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470693,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470694,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470695,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470696,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470697,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470698,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470699,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470700,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470701,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470702,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470703,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470704,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470705,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470706,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470707,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470708,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470709,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470710,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470711,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470712,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470713,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470714,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470715,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470716,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470717,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,404.16879,[M-H]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470718,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470719,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470720,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470721,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470722,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,440.14547,[M+Cl]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470723,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,450.17427,[M+FA]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470724,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,450.17427,[M+FA]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470725,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,450.17427,[M+FA]-,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470726,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,450.17427,[M+FA]-,15.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470727,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,450.17427,[M+FA]-,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470728,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470729,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470730,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470731,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470732,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470733,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470734,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470735,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470736,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470737,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470738,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470739,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470740,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470741,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,60.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470742,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,30.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470743,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O,406.18334,[M+H]+,20.0,val,CN1C(=O)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(N)=O)NC1=O
470744,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,356.12702,[M+Cl]-,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470745,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,356.12702,[M+Cl]-,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470746,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,356.12702,[M+Cl]-,60.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470747,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,356.12702,[M+Cl]-,30.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470748,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,356.12702,[M+Cl]-,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470749,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,320.15035,[M-H]-,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470750,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,320.15035,[M-H]-,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470751,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,320.15035,[M-H]-,60.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470752,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,320.15035,[M-H]-,15.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470753,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,320.15035,[M-H]-,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470754,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470755,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470756,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,30.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470757,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,60.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470758,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,15.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470759,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470760,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,60.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470761,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2,322.1649,[M+H]+,20.0,val,COc1cc(C(=O)NC2CCOC(C)(C)C2)cc2c1OCCO2
470762,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,322.1649,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470763,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,322.1649,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470764,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,322.1649,[M+H]+,60.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470765,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,322.1649,[M+H]+,30.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470766,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O,322.1649,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)C2CCCO2)cc(C)c1OCC(=O)O
470767,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,20.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470768,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,20.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470769,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,60.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470770,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,20.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470771,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,45.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470772,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,60.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470773,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,20.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470774,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1,322.1649,[M+H]+,45.0,val,O=C(O)c1ccc(OCC(O)CN2CCOCC23CCC3)cc1
470775,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,320.15035,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470776,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,320.15035,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470777,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,320.15035,[M-H]-,60.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470778,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,320.15035,[M-H]-,30.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470779,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,320.15035,[M-H]-,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470780,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,322.1649,[M+H]+,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470781,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,322.1649,[M+H]+,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470782,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,322.1649,[M+H]+,60.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470783,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,322.1649,[M+H]+,15.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470784,CC[C@@H](C)[C@H](NC(=O)Cc1cc2c(cc1)OCCCO2)C(=O)O,322.1649,[M+H]+,20.0,val,CC[C@@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCCCO2)C(=O)O
470785,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470786,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470787,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,30.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470788,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,60.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470789,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470790,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,45.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470791,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470792,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,320.15035,[M-H]-,60.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470793,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,322.1649,[M+H]+,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470794,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,322.1649,[M+H]+,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470795,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,322.1649,[M+H]+,60.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470796,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,322.1649,[M+H]+,30.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470797,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1,322.1649,[M+H]+,20.0,val,COc1ccc(C2(CNC(=O)CCC(=O)O)CCOCC2)cc1
470798,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470799,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470800,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470801,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,30.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470802,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470803,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470804,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,30.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470805,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,368.13826,[M-H]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470806,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,404.11494,[M+Cl]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470807,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,404.11494,[M+Cl]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470808,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,404.11494,[M+Cl]-,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470809,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,404.11494,[M+Cl]-,15.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470810,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,404.11494,[M+Cl]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470811,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,414.14374,[M+FA]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470812,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,414.14374,[M+FA]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470813,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,414.14374,[M+FA]-,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470814,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,414.14374,[M+FA]-,15.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470815,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,414.14374,[M+FA]-,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470816,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470817,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470818,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470819,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,30.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470820,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470821,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,60.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470822,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,30.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470823,COc1c(Cl)cc(OC)c(NC(=O)N2CCCC(CNC(C)=O)C2)c1,370.15281,[M+H]+,20.0,val,COc1cc(NC(=O)N2CCCC(CNC(C)=O)C2)c(OC)cc1Cl
470824,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,20.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470825,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,20.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470826,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,60.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470827,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,30.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470828,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,20.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470829,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,30.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470830,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,20.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470831,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1,310.15683,[M+H]+,60.0,val,O=C(CCOCCCc1ccc(Cl)cc1)N1CCCCC1
470832,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470833,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470834,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,60.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470835,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,30.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470836,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470837,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,60.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470838,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,30.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470839,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl,310.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NC2CCCCC2C)cc(C)c1Cl
470840,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470841,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470842,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470843,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,30.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470844,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470845,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470846,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,30.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470847,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,406.14177,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470848,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,442.11845,[M+Cl]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470849,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,442.11845,[M+Cl]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470850,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,442.11845,[M+Cl]-,60.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470851,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,442.11845,[M+Cl]-,15.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470852,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,442.11845,[M+Cl]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470853,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,452.14725,[M+FA]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470854,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,452.14725,[M+FA]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470855,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,452.14725,[M+FA]-,60.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470856,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,452.14725,[M+FA]-,15.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470857,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,452.14725,[M+FA]-,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470858,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,408.15632,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470859,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,408.15632,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470860,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,408.15632,[M+H]+,60.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470861,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,408.15632,[M+H]+,30.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470862,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ncc(C(F)(F)F)cc2)CC1,408.15632,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
470863,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,366.18346,[M+FA]-,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470864,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,366.18346,[M+FA]-,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470865,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,366.18346,[M+FA]-,60.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470866,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,366.18346,[M+FA]-,15.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470867,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,366.18346,[M+FA]-,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470868,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,20.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470869,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,20.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470870,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,60.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470871,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,30.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470872,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,20.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470873,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,60.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470874,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,30.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470875,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1,322.19253,[M+H]+,20.0,val,O=C(COC1CCNCC1)N1CCN(c2ccc(F)cc2)CC1
470876,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470877,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470878,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,30.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470879,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,60.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470880,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,15.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470881,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470882,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,60.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470883,CC(=O)N1CCC(CN(C)C(=O)NCc2cc(C)c(F)cc2)C1,322.19253,[M+H]+,20.0,val,CC(=O)N1CCC(CN(C)C(=O)NCc2ccc(F)c(C)c2)C1
470884,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470885,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470886,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470887,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470888,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470889,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470890,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470891,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,366.18346,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470892,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470893,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470894,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470895,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470896,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470897,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470898,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470899,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1,322.19253,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)NCC1(N2CCOCC2)CCC1
470900,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,20.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470901,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,20.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470902,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,60.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470903,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,30.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470904,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,20.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470905,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,60.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470906,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,30.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470907,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1,310.1813,[M+H]+,20.0,val,COC(=O)C(c1ccc(F)cc1)N(C)CCC1CCOCC1
470908,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,20.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470909,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,20.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470910,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,60.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470911,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,30.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470912,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,20.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470913,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,60.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470914,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,30.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470915,O=C(C1CCCCO1)N1CCC(Cc2cnccc2)CC1,289.19105,[M+H]+,20.0,val,O=C(C1CCCCO1)N1CCC(Cc2cccnc2)CC1
470916,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,20.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470917,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,20.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470918,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,60.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470919,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,20.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470920,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,60.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470921,COCC1(C(=O)Nc2cc3c(CCC3)nc2)CCCCC1,289.19105,[M+H]+,20.0,val,COCC1(C(=O)Nc2cnc3c(c2)CCC3)CCCCC1
470922,Cc1cc(C)c(CCC(=O)NC2CCCCNC2=O)cc1,289.19105,[M+H]+,20.0,val,Cc1ccc(CCC(=O)NC2CCCCNC2=O)c(C)c1
470923,Cc1cc(C)c(CCC(=O)NC2CCCCNC2=O)cc1,289.19105,[M+H]+,20.0,val,Cc1ccc(CCC(=O)NC2CCCCNC2=O)c(C)c1
470924,Cc1cc(C)c(CCC(=O)NC2CCCCNC2=O)cc1,289.19105,[M+H]+,60.0,val,Cc1ccc(CCC(=O)NC2CCCCNC2=O)c(C)c1
470925,Cc1cc(C)c(CCC(=O)NC2CCCCNC2=O)cc1,289.19105,[M+H]+,30.0,val,Cc1ccc(CCC(=O)NC2CCCCNC2=O)c(C)c1
470926,Cc1cc(C)c(CCC(=O)NC2CCCCNC2=O)cc1,289.19105,[M+H]+,20.0,val,Cc1ccc(CCC(=O)NC2CCCCNC2=O)c(C)c1
470927,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,20.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470928,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,20.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470929,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,60.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470930,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,20.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470931,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,45.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470932,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,60.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470933,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,20.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470934,CCCC1(CO)CCN(C(=O)c2c(C3CC3)nccc2)C1,289.19105,[M+H]+,45.0,val,CCCC1(CO)CCN(C(=O)c2cccnc2C2CC2)C1
470935,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,20.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470936,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,20.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470937,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,60.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470938,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,30.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470939,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,20.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470940,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,60.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470941,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,30.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470942,COc1ccccc1C1CCCN1CC(=O)NCC1CC1,289.19105,[M+H]+,20.0,val,COc1ccccc1C1CCCN1CC(=O)NCC1CC1
470943,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,20.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470944,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,20.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470945,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,60.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470946,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,30.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470947,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,20.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470948,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,60.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470949,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,30.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470950,CC1(C)COCCN1CC(=O)Nc1cc2c(cc1)CCC2,289.19105,[M+H]+,20.0,val,CC1(C)COCCN1CC(=O)Nc1ccc2c(c1)CCC2
470951,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,20.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470952,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,20.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470953,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,60.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470954,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,20.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470955,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,45.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470956,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,60.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470957,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,20.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470958,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1,289.19105,[M+H]+,45.0,val,NC(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1
470959,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,20.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470960,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,20.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470961,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,15.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470962,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,60.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470963,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,30.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470964,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,20.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470965,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,60.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470966,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2,289.19105,[M+H]+,20.0,val,CC(C)(C)OC(=O)[C@@]12CNC[C@@H]1CN(c1ccccc1)C2
470967,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,361.18813,[M+FA]-,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470968,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,361.18813,[M+FA]-,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470969,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,361.18813,[M+FA]-,60.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470970,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,361.18813,[M+FA]-,15.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470971,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,361.18813,[M+FA]-,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470972,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,20.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470973,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,20.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470974,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,60.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470975,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,30.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470976,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,20.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470977,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,60.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470978,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,30.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470979,COc1c(C)c(CN(C)C(=O)c2c(C)n(C)nc2C)ncc1C,317.1972,[M+H]+,20.0,val,COc1c(C)cnc(CN(C)C(=O)c2c(C)nn(C)c2C)c1C
470980,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,20.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470981,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,20.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470982,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,30.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470983,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,60.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470984,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,20.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470985,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,45.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470986,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,60.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470987,Cc1nc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)ncc1,317.1972,[M+H]+,20.0,val,Cc1ccnc(C2CCN(C(=O)C3(C)CCC(=O)NC3)CC2)n1
470988,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,20.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470989,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,20.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470990,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,30.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470991,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,60.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470992,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,15.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470993,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,20.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470994,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,60.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470995,Cc1nc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)ccc1,317.1972,[M+H]+,20.0,val,Cc1cccc(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)n1
470996,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470997,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470998,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,30.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
470999,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,60.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
471000,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,15.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
471001,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
471002,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,60.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
471003,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1,317.1972,[M+H]+,20.0,val,COCc1cn(-c2ccc(CNC(=O)CC(C)(C)C)cc2)nn1
471004,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,20.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471005,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,20.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471006,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,60.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471007,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,20.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471008,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,45.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471009,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,60.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471010,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,20.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471011,CN(C)c1cc(C(=O)N2CCC(N3CCCC3=O)CC2)ncc1,317.1972,[M+H]+,45.0,val,CN(C)c1ccnc(C(=O)N2CCC(N3CCCC3=O)CC2)c1
471012,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,315.18265,[M-H]-,30.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471013,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,315.18265,[M-H]-,30.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471014,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,315.18265,[M-H]-,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471015,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,361.18813,[M+FA]-,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471016,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,361.18813,[M+FA]-,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471017,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,361.18813,[M+FA]-,60.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471018,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,361.18813,[M+FA]-,15.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471019,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,361.18813,[M+FA]-,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471020,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2,317.1972,[M+H]+,20.0,val,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2
471021,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2,317.1972,[M+H]+,20.0,val,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2
471022,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2,317.1972,[M+H]+,60.0,val,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2
471023,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2,317.1972,[M+H]+,20.0,val,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2
471024,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2,317.1972,[M+H]+,60.0,val,CN(CC(=O)N1CCOCC1)c1nc(C2CC2)nc2c1CCC2
471025,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21,317.1972,[M+H]+,20.0,val,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21
471026,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21,317.1972,[M+H]+,20.0,val,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21
471027,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21,317.1972,[M+H]+,60.0,val,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21
471028,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21,317.1972,[M+H]+,30.0,val,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21
471029,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21,317.1972,[M+H]+,20.0,val,Cn1cc(NC(=O)NCCCN2CCOCC2)c2ccccc21
471030,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C,317.1972,[M+H]+,30.0,val,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C
471031,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C,317.1972,[M+H]+,30.0,val,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C
471032,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C,317.1972,[M+H]+,60.0,val,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C
471033,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C,317.1972,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C
471034,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C,317.1972,[M+H]+,30.0,val,Cc1ccc(-n2cc(C(=O)NCCCOC(C)C)nn2)cc1C
471035,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1,317.1972,[M+H]+,20.0,val,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1
471036,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1,317.1972,[M+H]+,20.0,val,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1
471037,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1,317.1972,[M+H]+,60.0,val,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1
471038,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1,317.1972,[M+H]+,15.0,val,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1
471039,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1,317.1972,[M+H]+,20.0,val,CN(c1cc(C#N)ccn1)C1CCN(C(=O)OC(C)(C)C)CC1
471040,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,45.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471041,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,45.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471042,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,45.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471043,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,20.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471044,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,60.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471045,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,20.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471046,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,60.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471047,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1,317.1972,[M+H]+,45.0,val,Cc1ccc(N2CC3CN(C(=O)C4CCOCC4)CC3C2)nn1
471048,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,20.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471049,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,20.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471050,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,60.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471051,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,30.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471052,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,20.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471053,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,30.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471054,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,60.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471055,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1,317.1972,[M+H]+,20.0,val,COc1ccccc1N1CCN(Cc2nc(C(C)C)no2)CC1
471056,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,15.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471057,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,15.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471058,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471059,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,60.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471060,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,15.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471061,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,45.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471062,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,60.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471063,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1,317.1972,[M+H]+,20.0,val,Cc1nc2ccccc2n1CC(=O)NCCCN1CCOCC1
471064,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471065,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471066,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,60.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471067,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471068,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,45.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471069,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,60.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471070,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471071,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,45.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471072,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471073,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471074,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,60.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471075,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471076,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,45.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471077,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,60.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471078,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,20.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471079,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2,290.17507,[M]+,45.0,val,C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
471080,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471081,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471082,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471083,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,30.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471084,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471085,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,30.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471086,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471087,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F,349.21466,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F
471088,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,20.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471089,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,20.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471090,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,45.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471091,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,60.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471092,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,20.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471093,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,20.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471094,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,45.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471095,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1,349.21466,[M+H]+,60.0,val,Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1
471096,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,20.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471097,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,20.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471098,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,60.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471099,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,30.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471100,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,20.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471101,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,60.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471102,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,30.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471103,O=C(NCCc1nc2c(CCCC2)s1)N1CCC2(CCO2)CC1,336.17402,[M+H]+,20.0,val,O=C(NCCc1nc2c(s1)CCCC2)N1CCC2(CCO2)CC1
471104,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471105,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471106,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,60.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471107,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,30.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471108,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471109,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,60.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471110,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,30.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471111,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471112,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,20.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471113,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,20.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471114,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,60.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471115,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,30.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471116,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,20.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471117,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,60.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471118,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,30.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471119,CN(C)c1c2cccc(S(=O)(=O)NCCCCCN)c2ccc1,336.17402,[M+H]+,20.0,val,CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12
471120,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471121,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471122,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,60.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471123,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471124,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,45.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471125,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,60.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471126,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471127,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,45.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471128,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,334.15947,[M-H]-,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471129,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,334.15947,[M-H]-,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471130,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,334.15947,[M-H]-,60.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471131,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,334.15947,[M-H]-,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471132,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,334.15947,[M-H]-,45.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471133,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471134,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471135,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,60.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471136,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,30.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471137,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471138,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,60.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471139,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,30.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471140,CN(C)CCc1c[nH]c2c1cc(CS(=O)(=O)N1CCCC1)cc2,336.17402,[M+H]+,20.0,val,CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
471141,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471142,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471143,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,60.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471144,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,20.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471145,CNS(=O)(=O)CCc1cc2c(cc1)[nH]cc2C1CCN(C)CC1,336.17402,[M+H]+,45.0,val,CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
471146,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,334.15947,[M-H]-,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471147,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,334.15947,[M-H]-,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471148,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,334.15947,[M-H]-,60.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471149,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,334.15947,[M-H]-,15.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471150,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,334.15947,[M-H]-,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471151,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471152,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471153,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,60.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471154,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,30.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471155,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471156,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471157,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471158,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,45.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471159,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,60.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471160,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471161,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,60.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471162,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,45.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471163,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O,336.17402,[M+H]+,20.0,val,Cn1cccc(C(=O)N2CCCN(C3CCSCC3)CC2)c1=O
471164,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1,336.17402,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1
471165,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1,336.17402,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1
471166,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1,336.17402,[M+H]+,60.0,val,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1
471167,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1,336.17402,[M+H]+,15.0,val,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1
471168,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1,336.17402,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)NCC(c2cccn2C)N(C)C)c1
471169,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471170,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471171,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,30.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471172,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,60.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471173,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471174,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,45.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471175,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,60.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471176,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,30.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471177,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O,336.17402,[M+H]+,20.0,val,CCN(CC)CCNC(=O)CC1CSc2ccccc2NC1=O
471178,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,20.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471179,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,20.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471180,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,60.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471181,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,20.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471182,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,45.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471183,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,60.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471184,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,20.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471185,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1,400.11817,[M+H]+,45.0,val,CCCCN1CCN(S(=O)(=O)c2cc(-c3nc(C)c(C)s3)cs2)CC1
471186,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471187,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471188,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,60.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471189,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,45.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471190,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,60.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471191,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,350.15439,[M-H]-,45.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471192,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,386.13106,[M+Cl]-,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471193,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,386.13106,[M+Cl]-,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471194,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,386.13106,[M+Cl]-,60.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471195,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,386.13106,[M+Cl]-,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471196,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,352.16894,[M+H]+,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471197,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,352.16894,[M+H]+,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471198,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,352.16894,[M+H]+,60.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471199,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,352.16894,[M+H]+,30.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471200,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1,352.16894,[M+H]+,20.0,val,CCCCCNC(=O)CC(C)CC1=NS(=O)(=O)c2ccccc2N1
471201,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,20.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471202,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,20.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471203,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,60.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471204,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,30.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471205,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,20.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471206,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,60.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471207,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,30.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471208,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1,352.16894,[M+H]+,20.0,val,CCC(CNS(=O)(=O)c1c(C)nn(C)c1C)(OC)c1ccccc1
471209,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,362.16562,[M-H]-,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471210,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,362.16562,[M-H]-,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471211,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,362.16562,[M-H]-,60.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471212,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,362.16562,[M-H]-,30.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471213,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,362.16562,[M-H]-,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471214,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471215,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471216,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,60.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471217,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,30.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471218,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471219,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,60.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471220,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,30.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471221,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,362.16562,[M-H]-,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471222,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471223,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471224,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,60.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471225,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,30.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471226,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471227,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,60.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471228,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,30.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471229,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1,364.18017,[M+H]+,20.0,val,O=C(Nc1nncs1)C1CCN(C(=O)NCC2CC3CCC2C3)CC1
471230,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,364.18017,[M+H]+,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471231,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,364.18017,[M+H]+,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471232,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,364.18017,[M+H]+,60.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471233,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,364.18017,[M+H]+,20.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471234,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1,364.18017,[M+H]+,45.0,val,Cc1ccc(C2CCN(c3nnc(C(C)NS(C)(=O)=O)n3C)C2)cc1
471235,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,363.17235,[M]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471236,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,363.17235,[M]+,60.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471237,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,363.17235,[M]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471238,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,363.17235,[M]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471239,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471240,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471241,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,60.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471242,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,15.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471243,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471244,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,60.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471245,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,15.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471246,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1,364.18017,[M+H]+,20.0,val,CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cccs2)CC1
471247,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471248,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471249,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,60.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471250,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,30.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471251,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471252,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,60.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471253,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,30.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471254,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1,364.18017,[M+H]+,20.0,val,Cn1cnc(S(=O)(=O)NCc2nn(C3CCCC3)c3c2CCCC3)c1
471255,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,15.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471256,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,15.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471257,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471258,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471259,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,15.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471260,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471261,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471262,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471263,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471264,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471265,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471266,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471267,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471268,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471269,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471270,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471271,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471272,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471273,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471274,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471275,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471276,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471277,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471278,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,60.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471279,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,30.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471280,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O,292.19072,[M+H]+,20.0,val,CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
471281,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471282,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471283,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471284,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471285,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471286,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471287,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471288,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471289,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471290,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471291,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471292,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471293,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471294,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471295,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471296,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471297,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471298,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,274.18016,[M+H-H2O]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471299,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471300,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471301,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471302,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471303,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471304,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,60.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471305,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,30.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471306,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1,292.19072,[M+H]+,20.0,val,CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1
471307,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,20.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471308,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,20.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471309,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,60.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471310,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,20.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471311,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,60.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471312,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23,292.19072,[M+H]+,20.0,val,CC[C@@H]1[C@H]2CCCCN3C(=O)C[C@H]([C@@H]4[C@H]1OC(=O)[C@H]4C)[C@@H]23
471313,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,290.17617,[M-H]-,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471314,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,290.17617,[M-H]-,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471315,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,290.17617,[M-H]-,60.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471316,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,290.17617,[M-H]-,30.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471317,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,290.17617,[M-H]-,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471318,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,292.19072,[M+H]+,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471319,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,292.19072,[M+H]+,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471320,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,292.19072,[M+H]+,60.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471321,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,292.19072,[M+H]+,15.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471322,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O,292.19072,[M+H]+,20.0,val,CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O
471323,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471324,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471325,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471326,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471327,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471328,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471329,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471330,Cc1c(C)cc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1,324.16279,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)CC(=O)NC2CCCCCC2)cc1C
471331,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,20.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471332,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,20.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471333,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,60.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471334,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,30.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471335,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,20.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471336,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,60.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471337,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,30.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471338,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1,324.16279,[M+H]+,20.0,val,CS(=O)(=O)CCC(=O)N1CCC(CCc2ccccc2)CC1
471339,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC,324.16279,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC
471340,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC,324.16279,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC
471341,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC,324.16279,[M+H]+,60.0,val,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC
471342,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC,324.16279,[M+H]+,15.0,val,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC
471343,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC,324.16279,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2C(C)(C)C2(C)C)c1C(=O)OC
471344,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,20.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471345,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,20.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471346,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,30.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471347,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,15.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471348,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,60.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471349,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,20.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471350,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,45.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471351,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,20.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471352,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1,324.16279,[M+H]+,60.0,val,CCOC(=O)c1cc(C(C)C)sc1NC(=O)C1CCCCC1
471353,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1,324.16279,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1
471354,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1,324.16279,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1
471355,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1,324.16279,[M+H]+,60.0,val,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1
471356,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1,324.16279,[M+H]+,15.0,val,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1
471357,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1,324.16279,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1
471358,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,20.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471359,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,20.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471360,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,60.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471361,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,30.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471362,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,20.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471363,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,30.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471364,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,20.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471365,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1,324.16279,[M+H]+,60.0,val,O=S(=O)(NCC1CCCO1)c1ccc(C2CCCCC2)cc1
471366,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C,362.13965,[M+Na]+,20.0,val,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C
471367,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C,362.13965,[M+Na]+,20.0,val,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C
471368,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C,362.13965,[M+Na]+,60.0,val,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C
471369,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C,362.13965,[M+Na]+,15.0,val,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C
471370,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C,362.13965,[M+Na]+,20.0,val,C=C[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C
471371,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,340.1577,[M+H]+,20.0,val,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
471372,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,340.1577,[M+H]+,20.0,val,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
471373,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,340.1577,[M+H]+,60.0,val,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
471374,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,340.1577,[M+H]+,15.0,val,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
471375,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1,340.1577,[M+H]+,20.0,val,CC(C)COC(=O)N1CCC(S(=O)(=O)Cc2ccccc2)CC1
471376,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,450.11389,[M+Cl]-,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471377,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,450.11389,[M+Cl]-,15.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471378,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471379,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471380,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471381,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,15.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471382,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471383,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471384,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,15.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471385,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,460.14269,[M+FA]-,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471386,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,416.15176,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471387,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,416.15176,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471388,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,416.15176,[M+H]+,60.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471389,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,416.15176,[M+H]+,30.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471390,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1,416.15176,[M+H]+,20.0,val,CN(c1ncc(Cl)cn1)C1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1
471391,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471392,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471393,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471394,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471395,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471396,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471397,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471398,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471399,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471400,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471401,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471402,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471403,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471404,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471405,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471406,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471407,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471408,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471409,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471410,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471411,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471412,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,60.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471413,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,20.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471414,Clc1ccc(CCCOCCCN2CCCCC2)cc1,296.17757,[M+H]+,45.0,val,Clc1ccc(CCCOCCCN2CCCCC2)cc1
471415,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,337.15914,[M-H]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471416,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,337.15914,[M-H]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471417,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,337.15914,[M-H]-,60.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471418,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,337.15914,[M-H]-,30.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471419,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,337.15914,[M-H]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471420,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,373.13581,[M+Cl]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471421,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,373.13581,[M+Cl]-,60.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471422,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,373.13581,[M+Cl]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471423,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471424,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471425,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,60.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471426,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,15.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471427,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471428,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,60.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471429,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,15.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471430,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,383.16462,[M+FA]-,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471431,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,339.17369,[M+H]+,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471432,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,339.17369,[M+H]+,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471433,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,339.17369,[M+H]+,60.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471434,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,339.17369,[M+H]+,15.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471435,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,339.17369,[M+H]+,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471436,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,361.15563,[M+Na]+,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471437,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1,361.15563,[M+Na]+,20.0,val,CCC(NC(=O)C1CCCN(S(C)(=O)=O)C1)c1ccc(C)cc1
471438,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2,339.17369,[M+H]+,20.0,val,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2
471439,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2,339.17369,[M+H]+,20.0,val,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2
471440,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2,339.17369,[M+H]+,60.0,val,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2
471441,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2,339.17369,[M+H]+,30.0,val,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2
471442,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2,339.17369,[M+H]+,20.0,val,CN(CCO)S(=O)(=O)c1ccccc1CNC1CCC12CCC2
471443,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,337.15914,[M-H]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471444,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,337.15914,[M-H]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471445,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,337.15914,[M-H]-,45.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471446,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,337.15914,[M-H]-,60.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471447,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,337.15914,[M-H]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471448,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471449,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471450,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,60.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471451,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,15.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471452,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471453,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,15.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471454,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471455,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,383.16462,[M+FA]-,60.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471456,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471457,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471458,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471459,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,30.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471460,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471461,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,30.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471462,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471463,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,337.15914,[M-H]-,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471464,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,373.13581,[M+Cl]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471465,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,373.13581,[M+Cl]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471466,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,373.13581,[M+Cl]-,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471467,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,373.13581,[M+Cl]-,15.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471468,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471469,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471470,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471471,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,15.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471472,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471473,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,15.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471474,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471475,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,383.16462,[M+FA]-,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471476,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471477,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471478,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471479,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,30.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471480,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471481,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,30.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471482,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471483,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,337.15914,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471484,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,373.13581,[M+Cl]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471485,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,373.13581,[M+Cl]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471486,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,373.13581,[M+Cl]-,15.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471487,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,383.16462,[M+FA]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471488,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,383.16462,[M+FA]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471489,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,383.16462,[M+FA]-,60.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471490,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,383.16462,[M+FA]-,15.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471491,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,383.16462,[M+FA]-,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471492,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471493,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471494,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,30.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471495,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,60.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471496,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,15.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471497,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471498,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,60.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471499,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1,339.17369,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1
471500,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471501,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471502,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,60.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471503,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,30.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471504,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471505,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,30.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471506,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471507,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1,339.17369,[M+H]+,60.0,val,CCN(CC)S(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1
471508,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471509,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471510,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,30.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471511,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,60.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471512,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,15.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471513,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471514,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,20.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471515,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1,339.17369,[M+H]+,60.0,val,CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1
471516,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471517,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471518,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,60.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471519,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,30.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471520,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471521,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,60.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471522,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,30.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471523,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C,339.17369,[M+H]+,20.0,val,Cc1cccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)c1C
471524,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471525,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471526,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471527,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471528,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,15.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471529,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471530,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471531,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1,339.17369,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1
471532,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,20.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471533,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,20.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471534,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,45.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471535,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,60.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471536,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,20.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471537,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,60.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471538,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,45.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471539,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1,339.17369,[M+H]+,20.0,val,CCc1ccc(S(=O)(=O)N2CCC(N3CCC(O)C3)CC2)cc1
471540,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471541,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471542,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,60.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471543,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471544,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,45.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471545,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,60.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471546,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1,339.17369,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)NCC2(N3CCOCC3)CCC2)c1
471547,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471548,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471549,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,15.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471550,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471551,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,30.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471552,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471553,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,20.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471554,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1,339.17369,[M+H]+,60.0,val,CC(NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1
471555,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471556,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
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471602,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12,424.18133,[M+NH4]+,20.0,val,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12
471603,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12,424.18133,[M+NH4]+,60.0,val,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12
471604,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12,424.18133,[M+NH4]+,15.0,val,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12
471605,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12,424.18133,[M+NH4]+,20.0,val,CC(=O)OC1(C)CC(O)C2(O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12
471606,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471607,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471608,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,60.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471609,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,15.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471610,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471611,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,60.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471612,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,15.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471613,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,424.18133,[M+NH4]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471614,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,429.13673,[M+Na]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471615,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,429.13673,[M+Na]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471616,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,429.13673,[M+Na]+,30.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471617,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,429.13673,[M+Na]+,20.0,val,CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
471618,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,441.11691,[M+Cl]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471619,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471620,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471621,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,60.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471622,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471623,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,451.14571,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12
471624,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C,327.18021,[M+H]+,30.0,val,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C
471625,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C,327.18021,[M+H]+,30.0,val,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C
471626,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C,327.18021,[M+H]+,20.0,val,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C
471627,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C,327.18021,[M+H]+,60.0,val,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C
471628,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C,327.18021,[M+H]+,30.0,val,CC(=O)OC1C=C(CO)C(=O)C(OC(=O)CC(C)C)C1C(C)C
471629,CCOc1c(OCC)c(Br)cc(CNCC2CCNCC2)c1,371.13287,[M+H]+,20.0,val,CCOc1cc(CNCC2CCNCC2)cc(Br)c1OCC
471630,CCOc1c(OCC)c(Br)cc(CNCC2CCNCC2)c1,371.13287,[M+H]+,20.0,val,CCOc1cc(CNCC2CCNCC2)cc(Br)c1OCC
471631,CCOc1c(OCC)c(Br)cc(CNCC2CCNCC2)c1,371.13287,[M+H]+,60.0,val,CCOc1cc(CNCC2CCNCC2)cc(Br)c1OCC
471632,CCOc1c(OCC)c(Br)cc(CNCC2CCNCC2)c1,371.13287,[M+H]+,30.0,val,CCOc1cc(CNCC2CCNCC2)cc(Br)c1OCC
471633,CCOc1c(OCC)c(Br)cc(CNCC2CCNCC2)c1,371.13287,[M+H]+,20.0,val,CCOc1cc(CNCC2CCNCC2)cc(Br)c1OCC
471634,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,406.18268,[M+Cl]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471635,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,406.18268,[M+Cl]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471636,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,406.18268,[M+Cl]-,15.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471637,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,406.18268,[M+Cl]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471638,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,416.21148,[M+FA]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471639,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,416.21148,[M+FA]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471640,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,416.21148,[M+FA]-,60.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471641,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,416.21148,[M+FA]-,15.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471642,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,416.21148,[M+FA]-,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471643,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471644,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471645,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,60.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471646,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,30.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471647,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471648,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,60.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471649,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,30.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471650,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1,372.22056,[M+H]+,20.0,val,O=C(NCc1nccn1C(F)F)NCC1(N2CCOCC2)CCCCC1
471651,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471652,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471653,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,30.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471654,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,60.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471655,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,15.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471656,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471657,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,60.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471658,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F,339.21908,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)CC2CN(C(=O)OC(C)(C)C)C2)c1F
471659,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,20.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471660,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,20.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471661,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,60.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471662,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,30.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471663,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,20.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471664,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,60.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471665,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,30.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471666,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1,322.19476,[M+H]+,20.0,val,CCc1ccc(CNC(=O)N2CCCC(N3CCCC3)C2)s1
471667,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,332.2092,[M-H]-,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471668,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,332.2092,[M-H]-,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471669,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,332.2092,[M-H]-,60.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471670,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,332.2092,[M-H]-,30.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471671,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,332.2092,[M-H]-,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471672,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,20.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471673,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,20.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471674,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,60.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471675,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,20.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471676,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,45.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471677,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,60.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471678,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,20.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471679,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O,334.22375,[M+H]+,45.0,val,CCN1CCCC(N2CC(NC(=O)Cc3cc(C)nn3C)C2)C1=O
471680,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,20.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471681,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,20.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471682,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,60.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471683,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,20.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471684,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,45.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471685,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,60.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471686,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,20.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471687,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1,334.22375,[M+H]+,45.0,val,CN(C)C(=O)N1CCN(C(=O)C2CCn3cncc3C2)C(C)(C)C1
471688,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471689,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471690,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,60.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471691,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,30.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471692,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471693,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,60.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471694,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,30.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471695,CCCC(=O)N1CCCC1C(=O)NCc1nnc2CCCCCn21,334.22375,[M+H]+,20.0,val,CCCC(=O)N1CCCC1C(=O)NCc1nnc2n1CCCCC2
471696,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,20.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471697,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,20.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471698,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,15.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471699,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,60.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471700,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,30.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471701,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,20.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471702,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,60.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471703,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1,334.22375,[M+H]+,20.0,val,COC(C)c1noc(CN2CCCN(C3CCC(C#N)C3)CC2)n1
471704,CN(CCCO)C1CCN(C(=O)Nc2nnc(C3CC3)cc2)CC1,334.22375,[M+H]+,20.0,val,CN(CCCO)C1CCN(C(=O)Nc2ccc(C3CC3)nn2)CC1
471705,CN(CCCO)C1CCN(C(=O)Nc2nnc(C3CC3)cc2)CC1,334.22375,[M+H]+,20.0,val,CN(CCCO)C1CCN(C(=O)Nc2ccc(C3CC3)nn2)CC1
471706,CN(CCCO)C1CCN(C(=O)Nc2nnc(C3CC3)cc2)CC1,334.22375,[M+H]+,60.0,val,CN(CCCO)C1CCN(C(=O)Nc2ccc(C3CC3)nn2)CC1
471707,CN(CCCO)C1CCN(C(=O)Nc2nnc(C3CC3)cc2)CC1,334.22375,[M+H]+,15.0,val,CN(CCCO)C1CCN(C(=O)Nc2ccc(C3CC3)nn2)CC1
471708,CN(CCCO)C1CCN(C(=O)Nc2nnc(C3CC3)cc2)CC1,334.22375,[M+H]+,20.0,val,CN(CCCO)C1CCN(C(=O)Nc2ccc(C3CC3)nn2)CC1
471709,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,20.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471710,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,20.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471711,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,60.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471712,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,15.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471713,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,20.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471714,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,45.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471715,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,60.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471716,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1,334.22375,[M+H]+,20.0,val,Cc1cc(N(C)C2CCN(CC(=O)N3CCOCC3)CC2)ncn1
471717,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1,334.22375,[M+H]+,20.0,val,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1
471718,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1,334.22375,[M+H]+,20.0,val,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1
471719,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1,334.22375,[M+H]+,45.0,val,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1
471720,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1,334.22375,[M+H]+,60.0,val,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1
471721,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1,334.22375,[M+H]+,20.0,val,CN1CCCC(C(=O)N2CCC(Oc3ccc(N(C)C)nn3)C2)C1
471722,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,360.20594,[M+Cl]-,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471723,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,360.20594,[M+Cl]-,15.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471724,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,370.23474,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471725,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,370.23474,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471726,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,370.23474,[M+FA]-,60.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471727,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,370.23474,[M+FA]-,15.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471728,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,370.23474,[M+FA]-,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471729,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,20.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471730,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,20.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471731,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,60.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471732,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,20.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471733,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,45.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471734,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,60.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471735,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,20.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471736,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1,326.24382,[M+H]+,45.0,val,CC(NC1CC(=O)N(CCN2CCOCC2)C1)C1(C)CCCO1
471737,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,326.24382,[M+H]+,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471738,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,326.24382,[M+H]+,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471739,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,326.24382,[M+H]+,60.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471740,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,326.24382,[M+H]+,30.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471741,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1,326.24382,[M+H]+,20.0,val,CC1(C)CC(NC(=O)N2CCN(C(=O)C(C)(C)C)CC2)CCO1
471742,CCCCCCCCCCCCCC(=O)OCC(O)CO,303.25299,[M+H]+,20.0,val,CCCCCCCCCCCCCC(=O)OCC(O)CO
471743,CCCCCCCCCCCCCC(=O)OCC(O)CO,303.25299,[M+H]+,20.0,val,CCCCCCCCCCCCCC(=O)OCC(O)CO
471744,CCCCCCCCCCCCCC(=O)OCC(O)CO,303.25299,[M+H]+,60.0,val,CCCCCCCCCCCCCC(=O)OCC(O)CO
471745,CCCCCCCCCCCCCC(=O)OCC(O)CO,303.25299,[M+H]+,30.0,val,CCCCCCCCCCCCCC(=O)OCC(O)CO
471746,CCCCCCCCCCCCCC(=O)OCC(O)CO,303.25299,[M+H]+,20.0,val,CCCCCCCCCCCCCC(=O)OCC(O)CO
471747,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C,302.26897,[M+H]+,20.0,val,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C
471748,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C,302.26897,[M+H]+,20.0,val,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C
471749,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C,302.26897,[M+H]+,45.0,val,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C
471750,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C,302.26897,[M+H]+,60.0,val,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C
471751,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C,302.26897,[M+H]+,20.0,val,CCC(C)(C)OCC(O)CN1C(C)(C)CC(O)CC1(C)C
471752,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl,389.00138,[M-H]-,20.0,val,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
471753,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl,389.00138,[M-H]-,20.0,val,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
471754,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl,389.00138,[M-H]-,60.0,val,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
471755,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl,389.00138,[M-H]-,30.0,val,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
471756,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl,389.00138,[M-H]-,20.0,val,N#CC(c1ccc(F)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
471757,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,458.0204,[M-H]-,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471758,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,458.0204,[M-H]-,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471759,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,458.0204,[M-H]-,60.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471760,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,458.0204,[M-H]-,30.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471761,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,458.0204,[M-H]-,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471762,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471763,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471764,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,60.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471765,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,30.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471766,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471767,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,60.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471768,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,30.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471769,O=C(NC(=Nc1n[nH]c(C(F)(F)F)c1)Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1,460.03495,[M+H]+,20.0,val,O=C(NC(=Nc1cc(C(F)(F)F)[nH]n1)Nc1cc(F)cc(Cl)c1)c1cccc(Cl)c1
471770,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12,300.06009,[M-H]-,20.0,val,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12
471771,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12,300.06009,[M-H]-,20.0,val,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12
471772,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12,300.06009,[M-H]-,75.0,val,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12
471773,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12,300.06009,[M-H]-,60.0,val,N#Cc1c(-c2ccccc2)cc(=S)n2c1[nH]c1ccccc12
471774,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471775,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471776,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471777,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471778,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471779,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,439.04264,[M-H]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471780,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,439.04264,[M-H]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471781,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,439.04264,[M-H]-,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471782,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,439.04264,[M-H]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471783,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,439.04264,[M-H]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471784,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,475.01932,[M+Cl]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471785,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,475.01932,[M+Cl]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471786,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,475.01932,[M+Cl]-,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471787,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,475.01932,[M+Cl]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471788,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,475.01932,[M+Cl]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471789,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471790,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471791,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471792,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471793,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471794,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471795,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471796,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,485.04812,[M+FA]-,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471797,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471798,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471799,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471800,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,15.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471801,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471802,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,45.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471803,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,60.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471804,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F,441.05719,[M+H]+,20.0,val,Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F
471805,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,60.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471806,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,60.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471807,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,20.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471808,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,60.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471809,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,20.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471810,Cc1cc(-c2nc3c(c(-c4ccccc4Cl)cs3)c(=O)[nH]2)ncc1,354.04624,[M+H]+,60.0,val,Cc1ccnc(-c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)c1
471811,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471812,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,60.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471813,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,30.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471814,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471815,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,60.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471816,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,30.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471817,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,331.06591,[M-H]-,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471818,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,377.07138,[M+FA]-,30.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471819,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,377.07138,[M+FA]-,30.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471820,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,377.07138,[M+FA]-,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471821,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,377.07138,[M+FA]-,60.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471822,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,377.07138,[M+FA]-,30.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471823,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,333.08046,[M+H]+,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471824,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,333.08046,[M+H]+,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471825,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,333.08046,[M+H]+,60.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471826,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,333.08046,[M+H]+,20.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471827,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12,333.08046,[M+H]+,45.0,val,O=c1[nH]c(=S)[nH]c2nc(-c3ccccc3)c(-c3ccccc3)nc12
471828,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471829,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471830,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,60.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471831,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471832,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471833,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,331.06591,[M-H]-,60.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471834,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,333.08046,[M+H]+,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471835,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,333.08046,[M+H]+,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471836,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,333.08046,[M+H]+,60.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471837,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,333.08046,[M+H]+,15.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471838,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12,333.08046,[M+H]+,20.0,val,Cc1nn(-c2ccccc2)c2[nH]c(=O)c(C#N)c(-c3cccs3)c12
471839,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1,401.01315,[M+H]+,20.0,val,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1
471840,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1,401.01315,[M+H]+,60.0,val,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1
471841,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1,401.01315,[M+H]+,15.0,val,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1
471842,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1,401.01315,[M+H]+,20.0,val,CCc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1Cc1ccco1
471843,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,453.04461,[M-H]-,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471844,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,453.04461,[M-H]-,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471845,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,453.04461,[M-H]-,60.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471846,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,453.04461,[M-H]-,30.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471847,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,453.04461,[M-H]-,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471848,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,455.05917,[M+H]+,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471849,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,455.05917,[M+H]+,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471850,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,455.05917,[M+H]+,60.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471851,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,455.05917,[M+H]+,30.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471852,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1,455.05917,[M+H]+,20.0,val,CC(ONC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cc1
471853,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1,336.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1
471854,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1,336.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1
471855,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1,336.09788,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1
471856,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1,336.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1
471857,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1,336.09788,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4ccc5c(c4)OCO5)n3)ccc2o1
471858,Cn1cc(-c2nn3c(Sc4cc5c(cc4)nccc5)nnc3cc2)cn1,360.10259,[M+H]+,20.0,val,Cn1cc(-c2ccc3nnc(Sc4ccc5ncccc5c4)n3n2)cn1
471859,Cn1cc(-c2nn3c(Sc4cc5c(cc4)nccc5)nnc3cc2)cn1,360.10259,[M+H]+,20.0,val,Cn1cc(-c2ccc3nnc(Sc4ccc5ncccc5c4)n3n2)cn1
471860,Cn1cc(-c2nn3c(Sc4cc5c(cc4)nccc5)nnc3cc2)cn1,360.10259,[M+H]+,60.0,val,Cn1cc(-c2ccc3nnc(Sc4ccc5ncccc5c4)n3n2)cn1
471861,Cn1cc(-c2nn3c(Sc4cc5c(cc4)nccc5)nnc3cc2)cn1,360.10259,[M+H]+,20.0,val,Cn1cc(-c2ccc3nnc(Sc4ccc5ncccc5c4)n3n2)cn1
471862,Cn1cc(-c2nn3c(Sc4cc5c(cc4)nccc5)nnc3cc2)cn1,360.10259,[M+H]+,60.0,val,Cn1cc(-c2ccc3nnc(Sc4ccc5ncccc5c4)n3n2)cn1
471863,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,376.06698,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471864,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,376.06698,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471865,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,376.06698,[M-H]-,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471866,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,376.06698,[M-H]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471867,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,376.06698,[M-H]-,45.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471868,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,412.04366,[M+Cl]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471869,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,412.04366,[M+Cl]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471870,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,412.04366,[M+Cl]-,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471871,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,412.04366,[M+Cl]-,15.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471872,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,412.04366,[M+Cl]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471873,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,422.07246,[M+FA]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471874,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,422.07246,[M+FA]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471875,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,422.07246,[M+FA]-,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471876,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,422.07246,[M+FA]-,15.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471877,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,422.07246,[M+FA]-,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471878,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,360.07098,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471879,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,360.07098,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471880,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,360.07098,[M+H-H2O]+,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471881,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,360.07098,[M+H-H2O]+,30.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471882,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,360.07098,[M+H-H2O]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471883,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471884,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471885,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471886,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,15.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471887,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471888,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,60.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471889,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,15.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471890,O=C(NC[C@@H](O)c1cc(Cl)ccc1)c1c(-c2c(F)cccc2F)[nH]nc1,378.08154,[M+H]+,20.0,val,O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cn[nH]c1-c1c(F)cccc1F
471891,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,334.0865,[M-H]-,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471892,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,334.0865,[M-H]-,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471893,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,334.0865,[M-H]-,60.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471894,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,334.0865,[M-H]-,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471895,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,334.0865,[M-H]-,60.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471896,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471897,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471898,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,45.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471899,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,60.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471900,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471901,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,45.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471902,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,60.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471903,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1,336.10105,[M+H]+,20.0,val,Clc1ccc(-n2ncc3c(NCc4ccccc4)ncnc32)cc1
471904,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1,390.11723,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1
471905,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1,390.11723,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1
471906,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1,390.11723,[M+H]+,60.0,val,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1
471907,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1,390.11723,[M+H]+,30.0,val,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1
471908,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1,390.11723,[M+H]+,20.0,val,O=C(c1cnccn1)N1CCCC1c1nc(-c2cccc(C(F)(F)F)c2)no1
471909,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,381.04854,[M-H]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471910,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,381.04854,[M-H]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471911,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,381.04854,[M-H]-,60.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471912,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,381.04854,[M-H]-,30.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471913,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,381.04854,[M-H]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471914,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,427.05402,[M+FA]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471915,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,427.05402,[M+FA]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471916,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,427.05402,[M+FA]-,60.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471917,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,427.05402,[M+FA]-,15.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471918,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,427.05402,[M+FA]-,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471919,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471920,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471921,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,60.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471922,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471923,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,45.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471924,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,60.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471925,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,20.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471926,O=S(=O)(CC1CSc2c3c(ncn2)ncn31)c1cc2ccccc2cc1,383.06309,[M+H]+,45.0,val,O=S(=O)(CC1CSc2ncnc3ncn1c23)c1ccc2ccccc2c1
471927,Cc1c2ccc3c(C(=O)C(=O)C4=C3OC[C@@H]4C)c2ccc1,279.10157,[M+H]+,30.0,val,Cc1cccc2c3c(ccc12)C1=C(C(=O)C3=O)[C@@H](C)CO1
471928,Cc1c2ccc3c(C(=O)C(=O)C4=C3OC[C@@H]4C)c2ccc1,279.10157,[M+H]+,30.0,val,Cc1cccc2c3c(ccc12)C1=C(C(=O)C3=O)[C@@H](C)CO1
471929,Cc1c2ccc3c(C(=O)C(=O)C4=C3OC[C@@H]4C)c2ccc1,279.10157,[M+H]+,20.0,val,Cc1cccc2c3c(ccc12)C1=C(C(=O)C3=O)[C@@H](C)CO1
471930,Cc1c2ccc3c(C(=O)C(=O)C4=C3OC[C@@H]4C)c2ccc1,279.10157,[M+H]+,60.0,val,Cc1cccc2c3c(ccc12)C1=C(C(=O)C3=O)[C@@H](C)CO1
471931,Cc1c2ccc3c(C(=O)C(=O)C4=C3OC[C@@H]4C)c2ccc1,279.10157,[M+H]+,30.0,val,Cc1cccc2c3c(ccc12)C1=C(C(=O)C3=O)[C@@H](C)CO1
471932,O=C(O)c1cc2ccccc2cc1OCc1ccccc1,279.10157,[M+H]+,15.0,val,O=C(O)c1cc2ccccc2cc1OCc1ccccc1
471933,O=C(O)c1cc2ccccc2cc1OCc1ccccc1,279.10157,[M+H]+,15.0,val,O=C(O)c1cc2ccccc2cc1OCc1ccccc1
471934,O=C(O)c1cc2ccccc2cc1OCc1ccccc1,279.10157,[M+H]+,20.0,val,O=C(O)c1cc2ccccc2cc1OCc1ccccc1
471935,O=C(O)c1cc2ccccc2cc1OCc1ccccc1,279.10157,[M+H]+,60.0,val,O=C(O)c1cc2ccccc2cc1OCc1ccccc1
471936,O=C(O)c1cc2ccccc2cc1OCc1ccccc1,279.10157,[M+H]+,15.0,val,O=C(O)c1cc2ccccc2cc1OCc1ccccc1
471937,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,20.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471938,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,20.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471939,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,60.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471940,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,30.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471941,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,20.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471942,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,60.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471943,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,30.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471944,CCCc1c(C(=O)O)cc2C(=O)c3c(C(=O)c2c1O)c(O)ccc3,325.07176,[M-H]-,20.0,val,CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O
471945,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,20.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471946,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,20.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471947,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,60.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471948,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,30.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471949,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,20.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471950,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,20.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471951,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,30.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471952,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,327.08631,[M+H]+,60.0,val,COc1c(OC(C)=O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
471953,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471954,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471955,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,30.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471956,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471957,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471958,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,45.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471959,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471960,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,326.11104,[M-H]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471961,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471962,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471963,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,15.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471964,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471965,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,15.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471966,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,362.08772,[M+Cl]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471967,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471968,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471969,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471970,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,15.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471971,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471972,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471973,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,15.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471974,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,372.11652,[M+FA]-,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471975,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,30.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471976,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,30.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471977,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,20.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471978,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,60.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471979,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,30.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471980,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,20.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471981,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,60.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471982,O=C(NCCc1cn(-c2ccccc2)nc1)c1c(F)c(F)ccc1,328.12559,[M+H]+,30.0,val,O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(F)c1F
471983,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471984,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471985,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471986,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471987,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,60.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471988,Cc1c(C(=O)NCc2cc(F)c(-n3ccnc3)cc2)cc(F)cc1,328.12559,[M+H]+,20.0,val,Cc1ccc(F)cc1C(=O)NCc1ccc(-n2ccnc2)c(F)c1
471989,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471990,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471991,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,45.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471992,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,60.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471993,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471994,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,45.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471995,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,60.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471996,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,342.10596,[M-H]-,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471997,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471998,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
471999,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,45.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472000,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,60.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472001,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472002,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,60.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472003,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,45.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472004,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1,344.12051,[M+H]+,20.0,val,CCOC(=O)c1cnc2nc(C)ccc2c1Nc1ccc(F)c(F)c1
472005,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472006,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472007,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472008,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472009,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472010,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472011,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472012,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C,344.12051,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc(F)cc(F)c2)c(=O)n(-c2ccccc2)n1C
472013,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1,338.11625,[M+H]+,20.0,val,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1
472014,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1,338.11625,[M+H]+,20.0,val,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1
472015,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1,338.11625,[M+H]+,45.0,val,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1
472016,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1,338.11625,[M+H]+,60.0,val,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1
472017,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1,338.11625,[M+H]+,20.0,val,CC1CCc2cc(F)ccc2N1C(=O)c1cccc(C(F)(F)F)c1
472018,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,337.11063,[M-H]-,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472019,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,337.11063,[M-H]-,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472020,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,337.11063,[M-H]-,60.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472021,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,337.11063,[M-H]-,30.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472022,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,337.11063,[M-H]-,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472023,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472024,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472025,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,60.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472026,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,30.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472027,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472028,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,60.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472029,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,30.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472030,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1,339.12518,[M+H]+,20.0,val,O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCc2ccccc2C1
472031,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,337.11063,[M-H]-,45.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472032,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,337.11063,[M-H]-,45.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472033,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,337.11063,[M-H]-,45.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472034,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,337.11063,[M-H]-,20.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472035,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,337.11063,[M-H]-,60.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472036,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,20.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472037,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,20.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472038,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,60.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472039,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,30.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472040,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,20.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472041,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,20.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472042,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,30.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472043,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C,321.11462,[M+H-H2O]+,60.0,val,Cc1ccc(N2C(=O)C3N=NN(c4ccc(F)cc4)C3C2=O)cc1C
472044,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1,339.12518,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1
472045,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1,339.12518,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1
472046,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1,339.12518,[M+H]+,45.0,val,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1
472047,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1,339.12518,[M+H]+,60.0,val,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1
472048,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1,339.12518,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1
472049,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472050,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472051,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472052,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472053,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,45.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472054,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472055,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472056,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,332.09754,[M-H]-,45.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472057,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,368.07422,[M+Cl]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472058,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,368.07422,[M+Cl]-,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472059,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,368.07422,[M+Cl]-,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472060,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472061,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472062,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472063,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472064,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,20.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472065,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1,334.11209,[M+H]+,60.0,val,CSc1nc(Nc2ccccc2)c2cnn(-c3ccccc3)c2n1
472066,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,443.03172,[M-H]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472067,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,443.03172,[M-H]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472068,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,443.03172,[M-H]-,60.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472069,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,443.03172,[M-H]-,30.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472070,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,443.03172,[M-H]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472071,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,479.0084,[M+Cl]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472072,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,479.0084,[M+Cl]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472073,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,479.0084,[M+Cl]-,60.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472074,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,479.0084,[M+Cl]-,15.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472075,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,479.0084,[M+Cl]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472076,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,489.0372,[M+FA]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472077,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,489.0372,[M+FA]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472078,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,489.0372,[M+FA]-,60.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472079,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,489.0372,[M+FA]-,15.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472080,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,489.0372,[M+FA]-,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472081,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,445.04627,[M+H]+,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472082,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,445.04627,[M+H]+,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472083,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,445.04627,[M+H]+,60.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472084,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,445.04627,[M+H]+,30.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472085,Cn1ncc(Cl)c1-c1c(Cl)sc(C(=O)N[C@H](CN)Cc2cc(F)c(F)cc2)c1,445.04627,[M+H]+,20.0,val,Cn1ncc(Cl)c1-c1cc(C(=O)N[C@H](CN)Cc2ccc(F)c(F)c2)sc1Cl
472086,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472087,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472088,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,60.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472089,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,30.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472090,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472091,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472092,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,30.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472093,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,405.03491,[M-H]-,60.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472094,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,451.04039,[M+FA]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472095,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,451.04039,[M+FA]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472096,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,451.04039,[M+FA]-,60.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472097,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,451.04039,[M+FA]-,15.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472098,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,451.04039,[M+FA]-,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472099,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472100,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472101,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,60.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472102,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,30.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472103,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472104,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,60.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472105,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,30.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472106,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1,407.04946,[M+H]+,20.0,val,Cn1c(CNC(=O)c2ccccc2)nnc1SCc1ccc(Cl)c(Cl)c1
472107,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,20.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472108,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,20.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472109,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,30.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472110,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,60.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472111,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,20.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472112,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,45.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472113,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,60.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472114,Cc1cc2c(ccc(NC(=O)C(=O)NCc3ccc(F)cc3)c2)[nH]1,326.12993,[M+H]+,20.0,val,Cc1cc2cc(NC(=O)C(=O)NCc3ccc(F)cc3)ccc2[nH]1
472115,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,20.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472116,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,20.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472117,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,60.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472118,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,20.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472119,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,45.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472120,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,60.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472121,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,20.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472122,CN(CC1COc2ccccc2O1)c1c2cc(F)ccc2ncn1,326.12993,[M+H]+,45.0,val,CN(CC1COc2ccccc2O1)c1ncnc2ccc(F)cc12
472123,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472124,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472125,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472126,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,30.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472127,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472128,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472129,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,30.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472130,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472131,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472132,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472133,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472134,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,15.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472135,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472136,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472137,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472138,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472139,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472140,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,45.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472141,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472142,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472143,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,45.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472144,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472145,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472146,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472147,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,30.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472148,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,324.11538,[M-H]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472149,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472150,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472151,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472152,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,15.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472153,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,370.12086,[M+FA]-,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472154,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472155,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472156,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472157,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472158,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,45.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472159,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,60.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472160,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,20.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472161,COc1c(OC)cc2c(c1)Cc1c-2[nH]nc1Nc1cc(F)ccc1,326.12993,[M+H]+,45.0,val,COc1cc2c(cc1OC)-c1[nH]nc(Nc3cccc(F)c3)c1C2
472162,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472163,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472164,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,60.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472165,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,30.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472166,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472167,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,30.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472168,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472169,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,324.11538,[M-H]-,60.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472170,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472171,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472172,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,60.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472173,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,30.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472174,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472175,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472176,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,30.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472177,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,324.11538,[M-H]-,60.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472178,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,360.09206,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472179,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,360.09206,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472180,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,360.09206,[M+Cl]-,60.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472181,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,360.09206,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472182,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,360.09206,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472183,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,324.11538,[M-H]-,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472184,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,324.11538,[M-H]-,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472185,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,324.11538,[M-H]-,60.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472186,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,324.11538,[M-H]-,30.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472187,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,324.11538,[M-H]-,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472188,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,324.11538,[M-H]-,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472189,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,324.11538,[M-H]-,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472190,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,324.11538,[M-H]-,45.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472191,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,324.11538,[M-H]-,60.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472192,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,324.11538,[M-H]-,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472193,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,326.12993,[M+H]+,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472194,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,326.12993,[M+H]+,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472195,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,326.12993,[M+H]+,60.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472196,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,326.12993,[M+H]+,15.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472197,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F,326.12993,[M+H]+,20.0,val,Cc1ccc(NC(=O)CNC(=O)c2c[nH]c3ccccc23)cc1F
472198,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,20.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472199,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,20.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472200,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,45.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472201,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,60.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472202,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,20.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472203,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,45.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472204,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,60.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472205,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1,326.12993,[M+H]+,20.0,val,CCc1cc(C2CC2)nc(NC(=O)c2cc3cc(F)ccc3o2)n1
472206,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,326.12993,[M+H]+,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472207,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,326.12993,[M+H]+,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472208,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,326.12993,[M+H]+,60.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472209,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,326.12993,[M+H]+,15.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472210,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1,326.12993,[M+H]+,20.0,val,Cc1ccc(CC(=O)Nc2nnc(Cc3ccc(F)cc3)o2)cc1
472211,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,326.12993,[M+H]+,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472212,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,326.12993,[M+H]+,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472213,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,326.12993,[M+H]+,60.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472214,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,326.12993,[M+H]+,30.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472215,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1,326.12993,[M+H]+,20.0,val,Cc1ccc(C)c(-c2nnc(NC(=O)Cc3ccc(F)cc3)o2)c1
472216,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472217,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472218,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,45.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472219,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,60.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472220,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472221,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,45.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472222,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,60.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472223,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C,326.12993,[M+H]+,20.0,val,COC(=O)c1cnc2nc(C)ccc2c1Nc1cc(F)ccc1C
472224,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472225,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472226,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,60.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472227,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,30.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472228,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472229,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,20.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472230,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,20.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472231,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,60.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472232,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,30.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472233,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,20.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472234,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,60.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472235,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,30.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472236,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F,342.12485,[M+H]+,20.0,val,Cc1nc2ccccn2c(=O)c1NC(=O)C(C)Oc1ccccc1F
472237,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472238,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472239,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,60.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472240,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,15.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472241,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O,342.12485,[M+H]+,20.0,val,CN1C(=O)NC(c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O
472242,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472243,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472244,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,432.02145,[M-H]-,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472245,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,432.02145,[M-H]-,30.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472246,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472247,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472248,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472249,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472250,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472251,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,45.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472252,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472253,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472254,COc1cccc(Nc2c3cc(I)cc(C)c3ncc2C(N)=O)c1,434.036,[M+H]+,45.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472255,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472256,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472257,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,45.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472258,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472259,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472260,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472261,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,45.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472262,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,432.02145,[M-H]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472263,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,467.99813,[M+Cl]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472264,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,467.99813,[M+Cl]-,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472265,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472266,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472267,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,30.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472268,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472269,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472270,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,45.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472271,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,60.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472272,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1,434.036,[M+H]+,20.0,val,COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(I)cc23)c1
472273,CCOc1ccccc1-c1nnc(COc2cc3c(cc2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472274,CCOc1ccccc1-c1nnc(COc2cc3c(cc2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472275,CCOc1ccccc1-c1nnc(COc2cc3c(cc2)OCO3)o1,341.1132,[M+H]+,60.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472276,CCOc1ccccc1-c1nnc(COc2cc3c(cc2)OCO3)o1,341.1132,[M+H]+,30.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472277,CCOc1ccccc1-c1nnc(COc2cc3c(cc2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472278,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1,339.09865,[M-H]-,20.0,val,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1
472279,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1,339.09865,[M-H]-,20.0,val,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1
472280,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1,339.09865,[M-H]-,60.0,val,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1
472281,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1,339.09865,[M-H]-,30.0,val,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1
472282,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1,339.09865,[M-H]-,20.0,val,Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(=O)[nH]c3c2)co1
472283,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472284,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472285,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,60.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472286,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,30.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472287,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472288,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,60.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472289,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,30.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472290,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1,341.1132,[M+H]+,20.0,val,CCOc1ccccc1-c1nnc(COc2ccc3c(c2)OCO3)o1
472291,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1,313.08929,[M+H]+,20.0,val,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1
472292,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1,313.08929,[M+H]+,20.0,val,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1
472293,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1,313.08929,[M+H]+,60.0,val,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1
472294,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1,313.08929,[M+H]+,30.0,val,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1
472295,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1,313.08929,[M+H]+,20.0,val,CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3cccs3)c2O)O1
472296,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1,422.05101,[M+H]+,20.0,val,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1
472297,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1,422.05101,[M+H]+,20.0,val,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1
472298,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1,422.05101,[M+H]+,30.0,val,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1
472299,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1,422.05101,[M+H]+,60.0,val,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1
472300,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1,422.05101,[M+H]+,20.0,val,O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cncc(Br)c1
472301,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472302,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472303,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,60.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472304,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472305,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,45.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472306,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,60.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472307,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472308,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,447.06079,[M-H]-,45.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472309,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,483.03747,[M+Cl]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472310,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,483.03747,[M+Cl]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472311,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,483.03747,[M+Cl]-,60.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472312,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,483.03747,[M+Cl]-,15.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472313,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,483.03747,[M+Cl]-,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472314,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,449.07534,[M+H]+,30.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472315,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,449.07534,[M+H]+,30.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472316,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,449.07534,[M+H]+,20.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472317,O=C(NCC1CCOCC1)c1cnc(Nc2c(Cl)cc(Cl)cc2)nc1C(F)(F)F,449.07534,[M+H]+,60.0,val,O=C(NCC1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F
472318,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,20.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472319,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,20.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472320,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,60.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472321,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,20.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472322,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,45.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472323,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,60.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472324,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,20.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472325,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(O)c2Cl,363.06409,[M-H]-,45.0,val,C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
472326,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472327,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472328,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,60.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472329,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472330,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,45.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472331,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,60.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472332,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472333,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,473.05706,[M-H]-,45.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472334,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,475.07161,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472335,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,475.07161,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472336,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,475.07161,[M+H]+,60.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472337,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,475.07161,[M+H]+,30.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472338,Cc1c(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc(NS(=O)(=O)c2nn(C)cc2)cc1,475.07161,[M+H]+,20.0,val,Cc1ccc(NS(=O)(=O)c2ccn(C)n2)cc1S(=O)(=O)Nc1cccc(C(F)(F)F)c1
472339,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,311.12013,[M-H]-,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472340,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,311.12013,[M-H]-,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472341,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,311.12013,[M-H]-,60.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472342,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,311.12013,[M-H]-,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472343,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,311.12013,[M-H]-,60.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472344,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472345,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472346,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,60.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472347,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,30.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472348,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472349,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,60.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472350,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,30.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472351,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2c1ccc(F)c2,313.13468,[M+H]+,20.0,val,O=C(c1ccc(C2CC2)[nH]c1=O)N1CCCc2cc(F)ccc21
472352,Cc1c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)ccc(F)c1,313.13468,[M+H]+,20.0,val,Cc1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
472353,Cc1c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)ccc(F)c1,313.13468,[M+H]+,20.0,val,Cc1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
472354,Cc1c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)ccc(F)c1,313.13468,[M+H]+,60.0,val,Cc1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
472355,Cc1c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)ccc(F)c1,313.13468,[M+H]+,15.0,val,Cc1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
472356,Cc1c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)ccc(F)c1,313.13468,[M+H]+,20.0,val,Cc1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O
472357,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1,313.13468,[M+H]+,20.0,val,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1
472358,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1,313.13468,[M+H]+,20.0,val,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1
472359,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1,313.13468,[M+H]+,60.0,val,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1
472360,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1,313.13468,[M+H]+,30.0,val,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1
472361,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1,313.13468,[M+H]+,20.0,val,CN(Cc1ccco1)C(=O)Cc1cccn1-c1ccc(F)cc1
472362,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472363,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472364,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,45.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472365,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472366,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472367,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,45.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472368,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472369,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,311.12013,[M-H]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472370,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,357.12561,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472371,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,357.12561,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472372,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,357.12561,[M+FA]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472373,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,357.12561,[M+FA]-,15.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472374,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,357.12561,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472375,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472376,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472377,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,311.12013,[M-H]-,60.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472378,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,311.12013,[M-H]-,30.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472379,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472380,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472381,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472382,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,45.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472383,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472384,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472385,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472386,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,311.12013,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472387,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,347.09681,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472388,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,347.09681,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472389,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,347.09681,[M+Cl]-,60.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472390,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,347.09681,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472391,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,347.09681,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472392,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472393,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472394,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,311.12013,[M-H]-,60.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472395,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,311.12013,[M-H]-,30.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472396,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,311.12013,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472397,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,357.12561,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472398,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,357.12561,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472399,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,357.12561,[M+FA]-,60.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472400,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,357.12561,[M+FA]-,15.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472401,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,357.12561,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472402,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472403,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472404,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472405,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472406,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472407,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472408,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472409,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1,313.13468,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(F)cc2)cc1NC(=O)C1CC1
472410,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472411,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472412,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472413,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,30.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472414,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472415,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472416,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472417,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,313.13468,[M+H]+,30.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472418,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472419,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472420,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,45.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472421,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472422,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472423,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472424,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,45.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472425,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1,335.11662,[M+Na]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C2(c3ccc(F)cc3)CC2)c1
472426,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472427,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472428,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,60.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472429,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,30.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472430,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472431,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,60.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472432,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,30.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472433,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(c2ccccc2)C1)c1ccccc1F
472434,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472435,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472436,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,60.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472437,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,30.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472438,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472439,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,60.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472440,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,30.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472441,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F,313.13468,[M+H]+,20.0,val,O=C(O)C(Cc1c[nH]c2ccccc12)NCc1ccccc1F
472442,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472443,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472444,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,60.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472445,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,30.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472446,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472447,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,60.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472448,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,30.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472449,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,371.09835,[M-H]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472450,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,417.10383,[M+FA]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472451,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,417.10383,[M+FA]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472452,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,417.10383,[M+FA]-,60.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472453,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,417.10383,[M+FA]-,15.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472454,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,417.10383,[M+FA]-,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472455,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,373.1129,[M+H]+,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472456,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,373.1129,[M+H]+,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472457,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,373.1129,[M+H]+,60.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472458,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,373.1129,[M+H]+,15.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472459,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1,373.1129,[M+H]+,20.0,val,O=C(Nc1ccc(F)cc1)N1CCC(c2nnc(-c3ccco3)s2)CC1
472460,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,20.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472461,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,20.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472462,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,60.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472463,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,30.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472464,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,20.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472465,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,30.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472466,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,60.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472467,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1,373.1129,[M+H]+,20.0,val,O=C(NCc1cccc(F)c1)N1CCC(c2noc(-c3cccs3)n2)C1
472468,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1,372.08349,[M+H]+,20.0,val,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1
472469,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1,372.08349,[M+H]+,20.0,val,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1
472470,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1,372.08349,[M+H]+,60.0,val,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1
472471,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1,372.08349,[M+H]+,15.0,val,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1
472472,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1,372.08349,[M+H]+,20.0,val,CCc1ccc(C(=O)NC(=S)Nc2nc3ccc(OC)cc3s2)cc1
472473,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472474,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472475,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472476,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,30.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472477,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472478,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472479,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,30.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472480,COc1c([N+](=O)[O-])cc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1,418.07144,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1[N+](=O)[O-]
472481,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,426.08124,[M-H]-,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472482,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,426.08124,[M-H]-,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472483,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,426.08124,[M-H]-,60.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472484,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,426.08124,[M-H]-,30.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472485,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,426.08124,[M-H]-,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472486,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472487,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472488,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,30.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472489,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,60.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472490,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,15.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472491,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472492,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,60.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472493,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12,428.09579,[M+H]+,20.0,val,COc1cccc2c(C)nc(Nc3nc(=O)cc(CSc4nnc(C)s4)[nH]3)nc12
472494,Cc1ccccc1-c1nc2c(c3c(CC(C)CC3)s2)c(=O)o1,312.10528,[M+H]+,20.0,val,Cc1ccccc1-c1nc2sc3c(c2c(=O)o1)CCC(C)C3
472495,Cc1ccccc1-c1nc2c(c3c(CC(C)CC3)s2)c(=O)o1,312.10528,[M+H]+,20.0,val,Cc1ccccc1-c1nc2sc3c(c2c(=O)o1)CCC(C)C3
472496,Cc1ccccc1-c1nc2c(c3c(CC(C)CC3)s2)c(=O)o1,312.10528,[M+H]+,60.0,val,Cc1ccccc1-c1nc2sc3c(c2c(=O)o1)CCC(C)C3
472497,Cc1ccccc1-c1nc2c(c3c(CC(C)CC3)s2)c(=O)o1,312.10528,[M+H]+,20.0,val,Cc1ccccc1-c1nc2sc3c(c2c(=O)o1)CCC(C)C3
472498,Cc1ccccc1-c1nc2c(c3c(CC(C)CC3)s2)c(=O)o1,312.10528,[M+H]+,45.0,val,Cc1ccccc1-c1nc2sc3c(c2c(=O)o1)CCC(C)C3
472499,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,20.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472500,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,20.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472501,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,60.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472502,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,15.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472503,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,20.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472504,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,60.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472505,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,20.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472506,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1,312.10528,[M+H]+,15.0,val,Cc1ccccc1C(=O)NCCc1ccc(-c2ccoc2)s1
472507,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3,312.10528,[M+H]+,20.0,val,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3
472508,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3,312.10528,[M+H]+,20.0,val,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3
472509,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3,312.10528,[M+H]+,60.0,val,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3
472510,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3,312.10528,[M+H]+,30.0,val,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3
472511,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3,312.10528,[M+H]+,20.0,val,O=c1oc(CCc2ccccc2)nc2sc3c(c12)CCCC3
472512,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12,312.10528,[M+H]+,20.0,val,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12
472513,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12,312.10528,[M+H]+,20.0,val,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12
472514,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12,312.10528,[M+H]+,60.0,val,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12
472515,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12,312.10528,[M+H]+,30.0,val,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12
472516,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12,312.10528,[M+H]+,20.0,val,CCCCOC(=O)c1cc(-c2cccs2)nc2ccccc12
472517,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,358.09323,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472518,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,358.09323,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472519,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,358.09323,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472520,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,358.09323,[M-H]-,30.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472521,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,358.09323,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472522,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,360.10778,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472523,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,360.10778,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472524,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,360.10778,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472525,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,360.10778,[M+H]+,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472526,O=C(/C=C/c1cc(O)c(O)cc1)N[C@@H](Cc1cc(O)c(O)cc1)C(=O)O,360.10778,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O
472527,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC,360.10778,[M+H]+,15.0,val,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC
472528,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC,360.10778,[M+H]+,15.0,val,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC
472529,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC,360.10778,[M+H]+,20.0,val,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC
472530,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC,360.10778,[M+H]+,60.0,val,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC
472531,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC,360.10778,[M+H]+,15.0,val,COc1cc(C(=O)OCc2cc(-c3ccco3)on2)cc(OC)c1OC
472532,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,414.05711,[M-H]-,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472533,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,414.05711,[M-H]-,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472534,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,414.05711,[M-H]-,45.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472535,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,414.05711,[M-H]-,60.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472536,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,414.05711,[M-H]-,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472537,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472538,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472539,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,60.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472540,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,30.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472541,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472542,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,30.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472543,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,60.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472544,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1,416.07166,[M+H]+,20.0,val,CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2Br)[nH]1
472545,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472546,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472547,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,60.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472548,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472549,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,45.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472550,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,60.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472551,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472552,Cc1c(C(=O)Nc2nn(-c3c(Cl)cccn3)cc2)ccc(C(C)C)n1,356.12726,[M+H]+,45.0,val,Cc1nc(C(C)C)ccc1C(=O)Nc1ccn(-c2ncccc2Cl)n1
472553,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472554,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472555,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472556,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472557,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472558,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472559,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472560,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472561,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472562,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472563,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472564,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,15.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472565,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472566,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472567,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472568,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472569,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472570,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472571,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,354.11271,[M-H]-,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472572,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,390.08939,[M+Cl]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472573,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,390.08939,[M+Cl]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472574,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,390.08939,[M+Cl]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472575,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,390.08939,[M+Cl]-,15.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472576,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,390.08939,[M+Cl]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472577,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472578,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472579,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472580,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,15.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472581,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,400.11819,[M+FA]-,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472582,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472583,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472584,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472585,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472586,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472587,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472588,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472589,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472590,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472591,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472592,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472593,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472594,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472595,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472596,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472597,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472598,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472599,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472600,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472601,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472602,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472603,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,60.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472604,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,20.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472605,OCCCNc1nccc(-c2nc(Nc3cc(Cl)ccc3)ncc2)c1,356.12726,[M+H]+,45.0,val,OCCCNc1cc(-c2ccnc(Nc3cccc(Cl)c3)n2)ccn1
472606,O=C(NC(=S)Nc1ncc(Cl)cc1)c1cc([N+](=O)[O-])c(N2CCCCC2)cc1,420.08916,[M+H]+,20.0,val,O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1
472607,O=C(NC(=S)Nc1ncc(Cl)cc1)c1cc([N+](=O)[O-])c(N2CCCCC2)cc1,420.08916,[M+H]+,20.0,val,O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1
472608,O=C(NC(=S)Nc1ncc(Cl)cc1)c1cc([N+](=O)[O-])c(N2CCCCC2)cc1,420.08916,[M+H]+,60.0,val,O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1
472609,O=C(NC(=S)Nc1ncc(Cl)cc1)c1cc([N+](=O)[O-])c(N2CCCCC2)cc1,420.08916,[M+H]+,15.0,val,O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1
472610,O=C(NC(=S)Nc1ncc(Cl)cc1)c1cc([N+](=O)[O-])c(N2CCCCC2)cc1,420.08916,[M+H]+,20.0,val,O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1
472611,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,363.09843,[M-H]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472612,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,363.09843,[M-H]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472613,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,363.09843,[M-H]-,60.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472614,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,363.09843,[M-H]-,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472615,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,363.09843,[M-H]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472616,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,399.07511,[M+Cl]-,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472617,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,399.07511,[M+Cl]-,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472618,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,399.07511,[M+Cl]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472619,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,399.07511,[M+Cl]-,60.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472620,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,399.07511,[M+Cl]-,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472621,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,409.10391,[M+FA]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472622,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,409.10391,[M+FA]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472623,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,409.10391,[M+FA]-,60.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472624,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,409.10391,[M+FA]-,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472625,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,409.10391,[M+FA]-,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472626,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,365.11298,[M+H]+,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472627,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,365.11298,[M+H]+,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472628,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,365.11298,[M+H]+,60.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472629,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,365.11298,[M+H]+,15.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472630,O=C(CCSCCC(=O)Nc1cc(F)ccc1)Nc1cc(F)ccc1,365.11298,[M+H]+,20.0,val,O=C(CCSCCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1
472631,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472632,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472633,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,60.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472634,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,30.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472635,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472636,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,60.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472637,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,30.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472638,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,392.13398,[M-H]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472639,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,428.11066,[M+Cl]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472640,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,428.11066,[M+Cl]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472641,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,428.11066,[M+Cl]-,60.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472642,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,428.11066,[M+Cl]-,15.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472643,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,428.11066,[M+Cl]-,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472644,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472645,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472646,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,60.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472647,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,15.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472648,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472649,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,60.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472650,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,15.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472651,Cc1nn2c(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)ccnc2c1,394.14853,[M+H]+,20.0,val,Cc1cc2nccc(NC(=O)NCc3ccc(COCC(F)(F)F)cc3)n2n1
472652,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472653,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472654,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,45.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472655,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,60.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472656,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472657,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,45.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472658,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,60.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472659,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,392.13398,[M-H]-,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472660,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472661,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472662,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,60.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472663,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,15.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472664,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472665,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,60.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472666,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,20.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472667,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21,394.14853,[M+H]+,15.0,val,CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3C(F)(F)F)cnc21
472668,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1,410.14345,[M+H]+,20.0,val,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1
472669,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1,410.14345,[M+H]+,20.0,val,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1
472670,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1,410.14345,[M+H]+,60.0,val,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1
472671,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1,410.14345,[M+H]+,30.0,val,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1
472672,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1,410.14345,[M+H]+,20.0,val,O=C(Nc1cc(N2CCCCC2)ncn1)NC1(C(F)(F)F)Oc2ccccc2O1
472673,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,20.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472674,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,20.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472675,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,45.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472676,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,60.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472677,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,20.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472678,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,45.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472679,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,60.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472680,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F,383.14895,[M+H]+,20.0,val,Cc1ncnc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)c1F
472681,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,20.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472682,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,20.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472683,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,45.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472684,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,60.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472685,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,20.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472686,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,60.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472687,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,20.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472688,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1,328.12782,[M+H]+,45.0,val,Cc1nnc(SCCCc2ccccc2)n1-c1ccc(F)cc1
472689,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472690,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472691,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472692,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472693,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472694,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472695,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472696,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472697,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472698,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472699,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472700,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472701,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472702,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472703,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,386.10925,[M-H]-,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472704,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472705,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472706,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472707,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472708,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472709,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472710,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472711,COc1c(-c2nc(Nc3cccc(CS(C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(CS(C)(=N)=O)c2)n1
472712,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472713,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472714,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472715,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472716,COc1c(-c2nc(Nc3cccc(C[S@@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@@](C)(=N)=O)c2)n1
472717,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472718,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472719,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472720,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472721,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472722,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,60.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472723,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,30.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472724,COc1c(-c2nc(Nc3cccc(C[S@](C)(=N)=O)c3)ncn2)ccc(F)c1,388.1238,[M+H]+,20.0,val,COc1cc(F)ccc1-c1ncnc(Nc2cccc(C[S@](C)(=N)=O)c2)n1
472725,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,20.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472726,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,20.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472727,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,60.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472728,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,30.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472729,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,20.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472730,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,60.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472731,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,30.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472732,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1,388.1238,[M+H]+,20.0,val,O=C(CSc1nnc2ccc(-c3ccc(F)cc3)nn12)NCC1CCCO1
472733,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,20.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472734,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,20.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472735,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,60.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472736,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,30.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472737,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,20.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472738,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,30.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472739,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,60.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472740,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1,316.11659,[M+H]+,20.0,val,Fc1ccc(COc2ccccc2C(=S)N2CCCC2)cc1
472741,CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(=O)O,389.06352,[M-H]-,20.0,val,CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O)CO1
472742,CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(=O)O,389.06352,[M-H]-,20.0,val,CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O)CO1
472743,CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(=O)O,389.06352,[M-H]-,60.0,val,CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O)CO1
472744,CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(=O)O,389.06352,[M-H]-,30.0,val,CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O)CO1
472745,CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(=O)O,389.06352,[M-H]-,20.0,val,CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O)CO1
472746,Cc1ccc(S(=O)(=O)c2c(N3CCOCC3)oc(-c3cccs3)n2)cc1,391.07808,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)c2nc(-c3cccs3)oc2N2CCOCC2)cc1
472747,Cc1ccc(S(=O)(=O)c2c(N3CCOCC3)oc(-c3cccs3)n2)cc1,391.07808,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)c2nc(-c3cccs3)oc2N2CCOCC2)cc1
472748,Cc1ccc(S(=O)(=O)c2c(N3CCOCC3)oc(-c3cccs3)n2)cc1,391.07808,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)c2nc(-c3cccs3)oc2N2CCOCC2)cc1
472749,Cc1ccc(S(=O)(=O)c2c(N3CCOCC3)oc(-c3cccs3)n2)cc1,391.07808,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)c2nc(-c3cccs3)oc2N2CCOCC2)cc1
472750,Cc1ccc(S(=O)(=O)c2c(N3CCOCC3)oc(-c3cccs3)n2)cc1,391.07808,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)c2nc(-c3cccs3)oc2N2CCOCC2)cc1
472751,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472752,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472753,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,60.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472754,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,15.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472755,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472756,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,60.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472757,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,15.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472758,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,341.1143,[M-H]-,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472759,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,343.12885,[M+H]+,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472760,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,343.12885,[M+H]+,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472761,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,343.12885,[M+H]+,60.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472762,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,343.12885,[M+H]+,30.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472763,O=C(NC(C(=O)O)c1cc2c(cc1)OCC2)c1noc2c1CCCC2,343.12885,[M+H]+,20.0,val,O=C(NC(C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2
472764,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,341.1143,[M-H]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472765,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,341.1143,[M-H]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472766,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,341.1143,[M-H]-,60.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472767,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,341.1143,[M-H]-,15.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472768,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,341.1143,[M-H]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472769,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,377.09097,[M+Cl]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472770,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,377.09097,[M+Cl]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472771,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,377.09097,[M+Cl]-,60.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472772,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,377.09097,[M+Cl]-,15.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472773,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,377.09097,[M+Cl]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472774,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,387.11977,[M+FA]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472775,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,387.11977,[M+FA]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472776,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,387.11977,[M+FA]-,60.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472777,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,387.11977,[M+FA]-,15.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472778,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,387.11977,[M+FA]-,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472779,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,343.12885,[M+H]+,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472780,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,343.12885,[M+H]+,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472781,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,343.12885,[M+H]+,60.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472782,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,343.12885,[M+H]+,15.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472783,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,343.12885,[M+H]+,20.0,val,CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1
472784,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472785,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472786,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,60.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472787,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,30.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472788,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472789,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,60.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472790,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,30.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472791,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C,343.12885,[M+H]+,20.0,val,Cc1cc(OC2CN(C(=O)c3ccc4c(c3)OCO4)C2)cc(=O)n1C
472792,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1,343.12885,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1
472793,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1,343.12885,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1
472794,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1,343.12885,[M+H]+,60.0,val,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1
472795,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1,343.12885,[M+H]+,30.0,val,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1
472796,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1,343.12885,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)c1ccnc(OC2CCOC2)c1
472797,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12,343.12885,[M+H]+,20.0,val,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12
472798,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12,343.12885,[M+H]+,20.0,val,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12
472799,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12,343.12885,[M+H]+,60.0,val,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12
472800,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12,343.12885,[M+H]+,15.0,val,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12
472801,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12,343.12885,[M+H]+,20.0,val,CCOC(=O)C1=C(N)OC(C)=C(C(C)=O)C12C(=O)Nc1ccccc12
472802,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472803,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472804,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,60.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472805,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472806,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,60.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472807,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,405.05844,[M-H]-,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472808,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,407.07299,[M+H]+,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472809,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,407.07299,[M+H]+,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472810,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,407.07299,[M+H]+,60.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472811,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,407.07299,[M+H]+,30.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472812,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1,407.07299,[M+H]+,20.0,val,O=C(c1ccc2c(c1)OCO2)N1C[C@H]2C[C@@H]1CC2NS(=O)(=O)c1cccs1
472813,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,321.1357,[M-H]-,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472814,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,321.1357,[M-H]-,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472815,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,321.1357,[M-H]-,60.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472816,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,321.1357,[M-H]-,30.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472817,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,321.1357,[M-H]-,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472818,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472819,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472820,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,60.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472821,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472822,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,45.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472823,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,60.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472824,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472825,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,321.1357,[M-H]-,45.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472826,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,357.11238,[M+Cl]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472827,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,357.11238,[M+Cl]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472828,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,357.11238,[M+Cl]-,60.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472829,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,357.11238,[M+Cl]-,15.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472830,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,367.14118,[M+FA]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472831,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,367.14118,[M+FA]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472832,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,367.14118,[M+FA]-,60.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472833,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,367.14118,[M+FA]-,15.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472834,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,367.14118,[M+FA]-,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472835,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,321.1357,[M-H]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472836,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,321.1357,[M-H]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472837,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,321.1357,[M-H]-,60.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472838,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,321.1357,[M-H]-,30.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472839,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,321.1357,[M-H]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472840,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,367.14118,[M+FA]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472841,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,367.14118,[M+FA]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472842,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,367.14118,[M+FA]-,60.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472843,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,367.14118,[M+FA]-,15.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472844,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,367.14118,[M+FA]-,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472845,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472846,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472847,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,60.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472848,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472849,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,60.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472850,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,321.1357,[M-H]-,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472851,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472852,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472853,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472854,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472855,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,15.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472856,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472857,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472858,Cc1c(C)oc(C(=O)N2CCc3c(nc[nH]3)C2c2cnccc2)c1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCc3[nH]cnc3C2c2cccnc2)oc1C
472859,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,20.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472860,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,20.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472861,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,60.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472862,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,15.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472863,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,20.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472864,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,45.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472865,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,60.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472866,CN(C(=O)c1cc(=O)[nH]c2c1n(C)cn2)C1Cc2ccccc2C1,323.15025,[M+H]+,20.0,val,CN(C(=O)c1cc(=O)[nH]c2ncn(C)c12)C1Cc2ccccc2C1
472867,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,323.15025,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472868,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,323.15025,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472869,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,323.15025,[M+H]+,60.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472870,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,323.15025,[M+H]+,15.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472871,Cc1c(NC(=O)CNC(=O)c2cc3c(cc2)[nH]nc3)c(C)ccc1,323.15025,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2[nH]ncc2c1
472872,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472873,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472874,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,60.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472875,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,15.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472876,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472877,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,60.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472878,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,15.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472879,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1,323.15025,[M+H]+,20.0,val,CN(Cc1ccccn1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
472880,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,20.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472881,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,20.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472882,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,60.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472883,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,30.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472884,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,20.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472885,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,60.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472886,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,30.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472887,Cn1nc2CCCc2c1C(=O)N(Cc1ccco1)c1ccccn1,323.15025,[M+H]+,20.0,val,Cn1nc2c(c1C(=O)N(Cc1ccco1)c1ccccn1)CCC2
472888,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472889,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472890,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,60.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472891,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,30.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472892,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472893,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,60.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472894,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,30.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472895,Cc1nn2cc(C(=O)N3CCC(c4ccccc4)C3)c(=O)[nH]c2c1,323.15025,[M+H]+,20.0,val,Cc1cc2[nH]c(=O)c(C(=O)N3CCC(c4ccccc4)C3)cn2n1
472896,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,321.1357,[M-H]-,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472897,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,321.1357,[M-H]-,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472898,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,321.1357,[M-H]-,60.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472899,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,321.1357,[M-H]-,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472900,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,321.1357,[M-H]-,45.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472901,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472902,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472903,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,60.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472904,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472905,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,45.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472906,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,60.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472907,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,20.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472908,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21,323.15025,[M+H]+,45.0,val,CCCn1c(NC(=O)c2cccc(C(N)=O)c2)nc2ccccc21
472909,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472910,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472911,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,30.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472912,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,60.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472913,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472914,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,45.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472915,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,60.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472916,COc1c2ccc(C(=O)N3CCCc4c3ccnc4)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
472917,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
472918,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
472919,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,321.1357,[M-H]-,60.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
472920,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,321.1357,[M-H]-,15.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
472921,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
472922,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472923,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472924,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472925,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,30.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472926,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472927,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472928,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,30.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472929,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,321.1357,[M-H]-,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472930,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,357.11238,[M+Cl]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472931,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,357.11238,[M+Cl]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472932,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,357.11238,[M+Cl]-,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472933,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,357.11238,[M+Cl]-,15.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472934,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,357.11238,[M+Cl]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472935,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,367.14118,[M+FA]-,15.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472936,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,367.14118,[M+FA]-,15.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472937,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,367.14118,[M+FA]-,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472938,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,367.14118,[M+FA]-,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472939,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,367.14118,[M+FA]-,15.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
472940,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472941,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472942,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,45.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472943,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,60.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472944,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472945,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472946,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,45.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472947,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,321.1357,[M-H]-,60.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
472948,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,321.1357,[M-H]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472949,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,321.1357,[M-H]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472950,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,321.1357,[M-H]-,60.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472951,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,321.1357,[M-H]-,15.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472952,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,321.1357,[M-H]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472953,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,367.14118,[M+FA]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472954,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,367.14118,[M+FA]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472955,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,367.14118,[M+FA]-,60.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472956,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,367.14118,[M+FA]-,15.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472957,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1,367.14118,[M+FA]-,20.0,val,N#Cc1ccc(C(=O)NC2CCC(Oc3ncccn3)CC2)cc1
472958,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472959,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472960,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,60.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472961,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,30.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472962,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472963,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472964,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,30.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472965,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,321.1357,[M-H]-,60.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
472966,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472967,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472968,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,321.1357,[M-H]-,60.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472969,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,321.1357,[M-H]-,30.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472970,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,321.1357,[M-H]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472971,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,367.14118,[M+FA]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472972,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,367.14118,[M+FA]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472973,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,367.14118,[M+FA]-,60.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472974,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,367.14118,[M+FA]-,15.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472975,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,367.14118,[M+FA]-,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
472976,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472977,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472978,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,60.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472979,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,30.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472980,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472981,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,30.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472982,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472983,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,321.1357,[M-H]-,60.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472984,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,367.14118,[M+FA]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472985,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,367.14118,[M+FA]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472986,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,367.14118,[M+FA]-,60.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472987,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,367.14118,[M+FA]-,15.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472988,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,367.14118,[M+FA]-,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
472989,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,321.1357,[M-H]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472990,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,321.1357,[M-H]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472991,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,321.1357,[M-H]-,45.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472992,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,321.1357,[M-H]-,60.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472993,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,321.1357,[M-H]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472994,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,357.11238,[M+Cl]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472995,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,357.11238,[M+Cl]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472996,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,357.11238,[M+Cl]-,60.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472997,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,357.11238,[M+Cl]-,15.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472998,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,357.11238,[M+Cl]-,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
472999,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473000,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473001,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,60.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473002,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,15.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473003,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473004,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473005,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,15.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473006,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,321.1357,[M-H]-,60.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473007,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473008,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473009,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,30.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473010,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,60.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473011,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473012,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,45.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473013,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473014,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,321.1357,[M-H]-,60.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473015,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,367.14118,[M+FA]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473016,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,367.14118,[M+FA]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473017,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,367.14118,[M+FA]-,60.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473018,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,367.14118,[M+FA]-,15.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473019,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,367.14118,[M+FA]-,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473020,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,367.14118,[M+FA]-,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473021,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,367.14118,[M+FA]-,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473022,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,367.14118,[M+FA]-,60.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473023,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,367.14118,[M+FA]-,15.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473024,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,367.14118,[M+FA]-,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473025,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473026,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473027,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,45.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473028,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473029,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473030,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,45.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473031,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473032,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,321.1357,[M-H]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473033,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,357.11238,[M+Cl]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473034,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,357.11238,[M+Cl]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473035,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,357.11238,[M+Cl]-,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473036,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,357.11238,[M+Cl]-,15.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473037,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,367.14118,[M+FA]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473038,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,367.14118,[M+FA]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473039,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,367.14118,[M+FA]-,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473040,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,367.14118,[M+FA]-,15.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473041,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,367.14118,[M+FA]-,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473042,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473043,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473044,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,60.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473045,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,30.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473046,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473047,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,30.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473048,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473049,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,321.1357,[M-H]-,60.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473050,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,357.11238,[M+Cl]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473051,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,357.11238,[M+Cl]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473052,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,357.11238,[M+Cl]-,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473053,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,321.1357,[M-H]-,20.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473054,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473055,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473056,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,321.1357,[M-H]-,45.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473057,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,321.1357,[M-H]-,60.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473058,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473059,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473060,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473061,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,60.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473062,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,15.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473063,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473064,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,15.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473065,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473066,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,367.14118,[M+FA]-,60.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473067,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473068,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473069,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473070,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,30.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473071,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473072,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,30.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473073,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473074,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,321.1357,[M-H]-,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473075,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,357.11238,[M+Cl]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473076,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,357.11238,[M+Cl]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473077,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,357.11238,[M+Cl]-,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473078,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,357.11238,[M+Cl]-,15.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473079,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,357.11238,[M+Cl]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473080,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473081,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473082,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473083,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,15.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473084,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473085,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473086,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473087,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,367.14118,[M+FA]-,15.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473088,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,367.14118,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473089,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,367.14118,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473090,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,367.14118,[M+FA]-,60.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473091,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,367.14118,[M+FA]-,15.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473092,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,367.14118,[M+FA]-,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473093,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,323.15025,[M+H]+,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473094,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,323.15025,[M+H]+,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473095,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,323.15025,[M+H]+,60.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473096,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,323.15025,[M+H]+,30.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473097,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C,323.15025,[M+H]+,20.0,val,Cc1cccc(NC(=O)Nc2c(C)nc3ccccn3c2=O)c1C
473098,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473099,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473100,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,60.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473101,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,30.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473102,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473103,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,60.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473104,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,30.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473105,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C,323.15025,[M+H]+,20.0,val,COc1c2ccc(C(=O)N3CCCc4cnccc43)cc2nn1C
473106,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473107,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473108,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473109,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,30.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473110,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473111,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,60.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473112,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,30.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473113,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1,323.15025,[M+H]+,20.0,val,O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2cc[nH]c2c1
473114,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1,323.15025,[M+H]+,20.0,val,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1
473115,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1,323.15025,[M+H]+,20.0,val,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1
473116,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1,323.15025,[M+H]+,60.0,val,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1
473117,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1,323.15025,[M+H]+,15.0,val,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1
473118,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1,323.15025,[M+H]+,20.0,val,Cc1noc(C2CN(C(=O)NCc3cccc4ccccc34)C2)n1
473119,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,20.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473120,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,20.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473121,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,60.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473122,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,15.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473123,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,20.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473124,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,60.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473125,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,15.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473126,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1,323.15025,[M+H]+,20.0,val,CCc1ccc(CNC(=O)Cc2nnc(-c3ccccn3)o2)cc1
473127,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473128,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473129,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,45.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473130,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,60.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473131,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473132,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,45.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473133,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,20.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473134,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N,323.15025,[M+H]+,60.0,val,CC(Cc1ccco1)N1CC(O)=C(c2nc3ccccc3[nH]2)C1=N
473135,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,304.13187,[M-H2O]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473136,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,304.13187,[M-H2O]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473137,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,304.13187,[M-H2O]+,60.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473138,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,304.13187,[M-H2O]+,30.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473139,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,304.13187,[M-H2O]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473140,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473141,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473142,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,60.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473143,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,15.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473144,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473145,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,60.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473146,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473147,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1,323.15025,[M+H]+,15.0,val,O=C(c1cc2ccccc2[nH]1)N1CCCC(Oc2cnccn2)C1
473148,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,305.13969,[M+H-H2O]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473149,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,305.13969,[M+H-H2O]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473150,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,305.13969,[M+H-H2O]+,45.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473151,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,305.13969,[M+H-H2O]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473152,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,323.15025,[M+H]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473153,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,323.15025,[M+H]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473154,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,323.15025,[M+H]+,60.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473155,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,323.15025,[M+H]+,15.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473156,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1,323.15025,[M+H]+,20.0,val,O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCn1cccc1
473157,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,20.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473158,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,20.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473159,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,60.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473160,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,30.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473161,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,20.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473162,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,60.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473163,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,30.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473164,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1,323.15025,[M+H]+,20.0,val,COc1cc(N2CCN(Cc3cccc(C#N)c3)CC2=O)ccn1
473165,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,20.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473166,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,20.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473167,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,30.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473168,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,60.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473169,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,15.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473170,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,20.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473171,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,60.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473172,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1,323.15025,[M+H]+,20.0,val,c1ccc(OCCNCc2cccc(Oc3ncccn3)c2)nc1
473173,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473174,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473175,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473176,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,15.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473177,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473178,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,45.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473179,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473180,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1
473181,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12,323.15025,[M+H]+,20.0,val,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12
473182,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12,323.15025,[M+H]+,20.0,val,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12
473183,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12,323.15025,[M+H]+,60.0,val,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12
473184,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12,323.15025,[M+H]+,30.0,val,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12
473185,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12,323.15025,[M+H]+,20.0,val,COc1ccccc1C(=O)Nc1cccn2nc(C3CCC3)nc12
473186,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473187,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473188,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,30.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473189,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,60.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473190,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,15.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473191,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473192,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,60.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473193,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1,323.15025,[M+H]+,20.0,val,Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4cc[nH]c4c3)C2)n1
473194,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473195,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473196,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,60.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473197,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473198,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,60.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473199,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1,323.15025,[M+H]+,20.0,val,COc1cccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1
473200,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473201,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473202,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,60.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473203,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,30.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473204,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473205,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,60.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473206,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,30.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473207,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1,323.15025,[M+H]+,20.0,val,O=C(NC(CO)Cc1ccccc1)c1cc(-c2ccccn2)n[nH]1
473208,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,20.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473209,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,20.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473210,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,60.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473211,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,15.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473212,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,20.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473213,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,20.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473214,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,60.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473215,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1,323.15025,[M+H]+,15.0,val,Cc1nc(Cn2cccc2C(=O)N2c3ccccc3CC2C)no1
473216,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473217,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473218,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,45.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473219,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,60.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473220,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473221,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,45.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473222,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,60.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473223,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12,323.15025,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)N3CCOCC3)nn12
473224,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473225,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473226,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,30.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473227,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473228,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473229,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,45.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473230,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473231,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473232,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1,323.15025,[M+H]+,30.0,val,COc1ccc(/C=N/NC(=O)CCc2nc3ccccc3[nH]2)cc1
473233,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,20.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473234,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,20.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473235,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,60.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473236,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,30.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473237,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,20.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473238,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,60.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473239,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,30.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473240,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1,323.15025,[M+H]+,20.0,val,O=C1CC(Cn2ccn3nccc3c2=O)CN1Cc1ccccc1
473241,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473242,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473243,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,30.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473244,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473245,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,15.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473246,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473247,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,60.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473248,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1,323.15025,[M+H]+,20.0,val,COc1ccc2cc(C(=O)NC3CN(c4ccccn4)C3)[nH]c2c1
473249,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473250,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473251,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,30.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473252,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,60.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473253,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,15.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473254,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473255,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,20.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473256,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1,323.15025,[M+H]+,60.0,val,Cc1ccc(OC2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1
473257,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1
473258,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1
473259,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1,323.15025,[M+H]+,60.0,val,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1
473260,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1,323.15025,[M+H]+,30.0,val,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1
473261,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1,323.15025,[M+H]+,20.0,val,Cc1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c(C)o1
473262,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1,323.15025,[M+H]+,20.0,val,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1
473263,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1,323.15025,[M+H]+,20.0,val,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1
473264,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1,323.15025,[M+H]+,60.0,val,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1
473265,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1,323.15025,[M+H]+,15.0,val,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1
473266,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1,323.15025,[M+H]+,20.0,val,O=C(c1ccc2[nH]ccc2c1)N1CCC(Oc2cccnn2)CC1
473267,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473268,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473269,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,60.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473270,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,15.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473271,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473272,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,60.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473273,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,20.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473274,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1,323.15025,[M+H]+,15.0,val,O=C(NCCc1ccccc1)NCc1nccnc1-c1ccoc1
473275,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,20.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473276,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,20.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473277,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,30.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473278,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,60.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473279,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,20.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473280,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,45.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473281,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,60.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473282,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1,323.15025,[M+H]+,20.0,val,N#Cc1cc2ccccc2nc1N1CCOC(C(=O)NC2CC2)C1
473283,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
473284,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
473285,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,323.15025,[M+H]+,60.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
473286,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,323.15025,[M+H]+,30.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
473287,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1,323.15025,[M+H]+,20.0,val,O=C(Cc1c[nH]c2ccccc12)N1CCC(Oc2cnccn2)C1
473288,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473289,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473290,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,30.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473291,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473292,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,15.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473293,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473294,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,60.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473295,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1,323.15025,[M+H]+,20.0,val,COc1ccc(C(=O)NCCn2ccnc2-c2cccnc2)cc1
473296,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,20.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473297,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,20.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473298,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,30.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473299,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,60.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473300,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,20.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473301,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,45.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473302,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,60.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473303,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1,323.15025,[M+H]+,20.0,val,Nc1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)no1
473304,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,20.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473305,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,20.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473306,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,45.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473307,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,60.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473308,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,20.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473309,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,45.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473310,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,60.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473311,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12,323.15025,[M+H]+,20.0,val,COc1ccccc1C=NNC(=O)c1c(C)nc2ccc(C)cn12
473312,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473313,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473314,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,323.15025,[M+H]+,60.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473315,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,323.15025,[M+H]+,15.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473316,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1,323.15025,[M+H]+,20.0,val,O=C(c1c[nH]c2ccccc12)N1CCCC(Oc2cccnn2)C1
473317,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,20.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473318,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,20.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473319,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,60.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473320,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,30.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473321,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,20.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473322,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,60.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473323,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,30.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473324,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1,347.17272,[M+H]+,20.0,val,c1ccc(NCC2CCN(c3nc4ccccc4n4nnnc34)C2)nc1
473325,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,391.16365,[M+FA]-,20.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473326,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,391.16365,[M+FA]-,60.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473327,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,391.16365,[M+FA]-,15.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473328,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,391.16365,[M+FA]-,20.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473329,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1,347.17272,[M+H]+,20.0,val,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1
473330,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1,347.17272,[M+H]+,20.0,val,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1
473331,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1,347.17272,[M+H]+,45.0,val,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1
473332,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1,347.17272,[M+H]+,60.0,val,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1
473333,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1,347.17272,[M+H]+,20.0,val,Cc1ccn(-c2ccc(N3CCN(c4cccnc4C#N)CC3)nn2)n1
473334,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1,347.17272,[M+H]+,45.0,val,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1
473335,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1,347.17272,[M+H]+,45.0,val,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1
473336,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1,347.17272,[M+H]+,45.0,val,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1
473337,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1,347.17272,[M+H]+,20.0,val,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1
473338,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1,347.17272,[M+H]+,60.0,val,Cc1nc(N2CCN(c3cnccc3C#N)CC2)cc(-n2cccn2)n1
473339,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,20.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473340,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,20.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473341,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,45.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473342,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,60.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473343,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,20.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473344,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,60.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473345,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,45.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473346,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12,347.17272,[M+H]+,20.0,val,Cc1nnc2c(N3CCC4CN(c5ccc(C#N)cn5)CC43)nccn12
473347,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,20.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473348,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,20.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473349,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,60.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473350,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,20.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473351,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,60.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473352,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21,347.17272,[M+H]+,20.0,val,Cn1cnc2c(N3CC4CN(c5ncccc5C#N)CC4C3)ncnc21
473353,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,347.17272,[M+H]+,20.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473354,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,347.17272,[M+H]+,20.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473355,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,347.17272,[M+H]+,60.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473356,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,347.17272,[M+H]+,20.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473357,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12,347.17272,[M+H]+,60.0,val,Cc1nnc2ccc(N3CC4CN(c5cccnc5C#N)CC4C3)nn12
473358,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473359,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473360,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473361,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473362,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473363,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473364,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473365,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473366,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473367,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473368,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473369,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473370,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473371,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473372,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473373,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,60.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473374,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,30.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473375,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473376,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,60.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473377,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,30.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473378,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,313.10815,[M-H]-,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473379,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1
473380,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1
473381,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1
473382,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1,315.1227,[M+H]+,15.0,val,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1
473383,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(CC(=O)OCC(=O)c2ccc(OC)cc2)cc1
473384,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O,315.1227,[M+H]+,20.0,val,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O
473385,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O,315.1227,[M+H]+,20.0,val,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O
473386,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O,315.1227,[M+H]+,60.0,val,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O
473387,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O,315.1227,[M+H]+,30.0,val,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O
473388,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O,315.1227,[M+H]+,20.0,val,COc1ccc2c(c1)OC(c1ccc(OC)c(OC)c1)CC2=O
473389,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,297.11214,[M+H-H2O]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473390,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,297.11214,[M+H-H2O]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473391,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,297.11214,[M+H-H2O]+,60.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473392,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,297.11214,[M+H-H2O]+,30.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473393,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,297.11214,[M+H-H2O]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473394,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,315.1227,[M+H]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473395,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,315.1227,[M+H]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473396,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,315.1227,[M+H]+,60.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473397,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,315.1227,[M+H]+,15.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473398,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC,315.1227,[M+H]+,20.0,val,CCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OCC
473399,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O,313.10815,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O
473400,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O,313.10815,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O
473401,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O,313.10815,[M-H]-,60.0,val,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O
473402,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O,313.10815,[M-H]-,30.0,val,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O
473403,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O,313.10815,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)OCCc2ccc(O)cc2)ccc1O
473404,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473405,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473406,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473407,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473408,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473409,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473410,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473411,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473412,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,337.10464,[M+Na]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473413,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1,337.10464,[M+Na]+,20.0,val,COc1ccc(C2CC(=O)c3c(OC)cc(OC)cc3O2)cc1
473414,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473415,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473416,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473417,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473418,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473419,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,60.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473420,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,30.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473421,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1,315.1227,[M+H]+,20.0,val,COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1
473422,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473423,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473424,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,60.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473425,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473426,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,60.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473427,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,390.08939,[M-H]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473428,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,426.06607,[M+Cl]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473429,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,426.06607,[M+Cl]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473430,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,426.06607,[M+Cl]-,60.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473431,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,426.06607,[M+Cl]-,15.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473432,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,426.06607,[M+Cl]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473433,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,436.09487,[M+FA]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473434,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,436.09487,[M+FA]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473435,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,436.09487,[M+FA]-,60.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473436,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,436.09487,[M+FA]-,15.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473437,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,436.09487,[M+FA]-,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473438,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,392.10394,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473439,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,392.10394,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473440,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,392.10394,[M+H]+,60.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473441,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,392.10394,[M+H]+,30.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473442,CCn1cnnc1C1CCN(C(=O)c2cc3c(ccc(Cl)c3Cl)[nH]2)CC1,392.10394,[M+H]+,20.0,val,CCn1cnnc1C1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)CC1
473443,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,386.13017,[M-H]-,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473444,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,386.13017,[M-H]-,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473445,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,386.13017,[M-H]-,60.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473446,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,386.13017,[M-H]-,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473447,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,386.13017,[M-H]-,60.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473448,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,388.14473,[M+H]+,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473449,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,388.14473,[M+H]+,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473450,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,388.14473,[M+H]+,60.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473451,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,388.14473,[M+H]+,15.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473452,CN1CCC(Nc2ncc3ncnc(Nc4cc(Cl)c(F)cc4)c3n2)CC1,388.14473,[M+H]+,20.0,val,CN1CCC(Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1
473453,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473454,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473455,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,60.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473456,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473457,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,45.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473458,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,60.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473459,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473460,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2c1cc(Cl)cc2,379.08777,[M+H]+,45.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCSc2ccc(Cl)cc21
473461,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473462,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473463,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473464,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473465,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473466,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473467,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473468,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,377.07322,[M-H]-,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473469,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,413.04989,[M+Cl]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473470,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,413.04989,[M+Cl]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473471,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,413.04989,[M+Cl]-,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473472,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,413.04989,[M+Cl]-,15.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473473,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,413.04989,[M+Cl]-,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473474,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,379.08777,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473475,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,379.08777,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473476,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,379.08777,[M+H]+,45.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473477,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,379.08777,[M+H]+,60.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473478,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21,379.08777,[M+H]+,20.0,val,CCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(Cl)c3)ccc21
473479,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,393.06813,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473480,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,393.06813,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473481,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,393.06813,[M-H]-,60.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473482,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,393.06813,[M-H]-,30.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473483,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,393.06813,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473484,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,429.04481,[M+Cl]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473485,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,429.04481,[M+Cl]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473486,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,429.04481,[M+Cl]-,60.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473487,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,429.04481,[M+Cl]-,15.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473488,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,439.07361,[M+FA]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473489,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,439.07361,[M+FA]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473490,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,439.07361,[M+FA]-,60.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473491,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,439.07361,[M+FA]-,15.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473492,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,439.07361,[M+FA]-,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473493,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1,395.08268,[M+H]+,30.0,val,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1
473494,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1,395.08268,[M+H]+,30.0,val,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1
473495,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1,395.08268,[M+H]+,20.0,val,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1
473496,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1,395.08268,[M+H]+,60.0,val,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1
473497,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1,395.08268,[M+H]+,30.0,val,COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCCCS2(=O)=O)cc1
473498,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,395.08268,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473499,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,395.08268,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473500,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,395.08268,[M+H]+,60.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473501,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,395.08268,[M+H]+,30.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473502,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1,395.08268,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c1
473503,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473504,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473505,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,30.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473506,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473507,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473508,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,45.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473509,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473510,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,367.1275,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473511,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,403.10418,[M+Cl]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473512,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,403.10418,[M+Cl]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473513,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,403.10418,[M+Cl]-,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473514,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,403.10418,[M+Cl]-,15.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473515,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,403.10418,[M+Cl]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473516,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473517,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473518,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473519,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,15.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473520,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473521,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473522,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,15.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473523,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,413.13298,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473524,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473525,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473526,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473527,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,30.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473528,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473529,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,60.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473530,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,30.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473531,COCCn1cc(C(=O)NC(C)c2cc(C(F)(F)F)ccc2)ccc1=O,369.14205,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(C)c2cccc(C(F)(F)F)c2)ccc1=O
473532,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,20.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473533,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,20.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473534,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,60.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473535,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,15.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473536,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,20.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473537,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,60.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473538,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,15.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473539,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1,369.14205,[M+H]+,20.0,val,COc1ccc(OCCCn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1
473540,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473541,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473542,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,60.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473543,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,30.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473544,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473545,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,60.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473546,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,30.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473547,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,459.09555,[M-H]-,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473548,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473549,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473550,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,60.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473551,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,15.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473552,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473553,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,60.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473554,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,15.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473555,Cc1c(C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)sc(-c2ccc(OC(F)(F)F)cc2)n1,461.1101,[M+H]+,20.0,val,Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)N[C@@H](CCCNC(N)=O)C(=O)O
473556,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21,405.17575,[M+H]+,20.0,val,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21
473557,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21,405.17575,[M+H]+,20.0,val,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21
473558,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21,405.17575,[M+H]+,45.0,val,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21
473559,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21,405.17575,[M+H]+,60.0,val,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21
473560,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21,405.17575,[M+H]+,20.0,val,Cn1cnc2c(N3CCN(c4cc(C(F)(F)F)nc(C5CC5)n4)CC3)ncnc21
473561,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1,405.17575,[M+H]+,20.0,val,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1
473562,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1,405.17575,[M+H]+,20.0,val,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1
473563,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1,405.17575,[M+H]+,60.0,val,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1
473564,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1,405.17575,[M+H]+,20.0,val,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1
473565,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1,405.17575,[M+H]+,60.0,val,CC1CC2CN(c3ncnc4c3cnn4C)CC2N1c1nccc(C(F)(F)F)n1
473566,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,481.15651,[M+FA]-,20.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473567,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,481.15651,[M+FA]-,60.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473568,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,481.15651,[M+FA]-,15.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473569,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,481.15651,[M+FA]-,20.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473570,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,437.16558,[M+H]+,20.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473571,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O,437.16558,[M+H]+,20.0,val,Cn1c(N2CC3CN(c4ccc5nnc(C(F)(F)F)n5n4)CC3C2)cc(=O)n(C)c1=O
473572,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473573,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473574,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,60.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473575,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473576,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,45.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473577,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,60.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473578,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473579,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,329.1307,[M-H]-,45.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473580,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,365.10737,[M+Cl]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473581,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,365.10737,[M+Cl]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473582,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,365.10737,[M+Cl]-,60.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473583,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,365.10737,[M+Cl]-,15.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473584,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,375.13617,[M+FA]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473585,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,375.13617,[M+FA]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473586,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,375.13617,[M+FA]-,60.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473587,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,375.13617,[M+FA]-,15.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473588,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,375.13617,[M+FA]-,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473589,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473590,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473591,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473592,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473593,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,45.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473594,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473595,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473596,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,329.1307,[M-H]-,45.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473597,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,365.10737,[M+Cl]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473598,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,365.10737,[M+Cl]-,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473599,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,365.10737,[M+Cl]-,15.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473600,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,365.10737,[M+Cl]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473601,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,375.13617,[M+FA]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473602,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,375.13617,[M+FA]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473603,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,375.13617,[M+FA]-,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473604,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,375.13617,[M+FA]-,15.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473605,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,375.13617,[M+FA]-,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473606,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473607,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473608,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473609,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473610,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,45.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473611,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,60.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473612,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,20.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473613,O=C(NCC(CO)Cc1cnccc1)C1Cc2c(ccc(F)c2)O1,331.14525,[M+H]+,45.0,val,O=C(NCC(CO)Cc1cccnc1)C1Cc2cc(F)ccc2O1
473614,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,331.14525,[M+H]+,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473615,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,331.14525,[M+H]+,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473616,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,331.14525,[M+H]+,60.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473617,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,331.14525,[M+H]+,15.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473618,O=C(Nc1cn(Cc2cc(F)ccc2)c(=O)cc1)C1CCCOC1,331.14525,[M+H]+,20.0,val,O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)C1CCCOC1
473619,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,20.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473620,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,20.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473621,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,60.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473622,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,30.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473623,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,20.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473624,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,60.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473625,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,30.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473626,CN(C(=O)C1CCN(C(=O)c2cocc2)CC1)c1ccccc1F,331.14525,[M+H]+,20.0,val,CN(C(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1F
473627,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473628,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473629,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,60.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473630,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,30.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473631,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473632,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,60.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473633,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,30.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473634,O=C(c1coc(C2CCOCC2)n1)N1CCCc2c1cc(F)cc2,331.14525,[M+H]+,20.0,val,O=C(c1coc(C2CCOCC2)n1)N1CCCc2ccc(F)cc21
473635,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,329.1307,[M-H]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473636,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,329.1307,[M-H]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473637,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,329.1307,[M-H]-,60.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473638,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,329.1307,[M-H]-,30.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473639,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,329.1307,[M-H]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473640,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,365.10737,[M+Cl]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473641,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,365.10737,[M+Cl]-,45.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473642,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,365.10737,[M+Cl]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473643,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,375.13617,[M+FA]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473644,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,375.13617,[M+FA]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473645,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,375.13617,[M+FA]-,60.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473646,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,375.13617,[M+FA]-,15.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473647,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,375.13617,[M+FA]-,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473648,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473649,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473650,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,45.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473651,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,60.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473652,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473653,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,45.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473654,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,60.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473655,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2,331.14525,[M+H]+,20.0,val,COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2
473656,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F,331.14525,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F
473657,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F,331.14525,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F
473658,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F,331.14525,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F
473659,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F,331.14525,[M+H]+,30.0,val,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F
473660,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F,331.14525,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCC(Oc3ccc(C)cn3)C2)cc1F
473661,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,20.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473662,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,20.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473663,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,60.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473664,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,15.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473665,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,20.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473666,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,20.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473667,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,60.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473668,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1,343.13872,[M+H]+,15.0,val,CC(C)(C)c1ccc(CSc2nnnn2-c2ccccc2F)cc1
473669,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,20.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473670,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,20.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473671,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,60.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473672,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,20.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473673,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,45.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473674,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,60.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473675,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,20.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473676,Cc1c(C(=O)NCc2nc(N(C)C)ccc2)oc2ccccc12,310.155,[M+H]+,45.0,val,Cc1c(C(=O)NCc2cccc(N(C)C)n2)oc2ccccc12
473677,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473678,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473679,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473680,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473681,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473682,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473683,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473684,Cc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)c(C)n1
473685,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473686,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473687,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473688,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473689,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473690,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473691,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473692,Cc1ccc(N2CCN(C(=O)c3cnc(C)cc3)CC2=O)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(N2CCN(C(=O)c3ccc(C)nc3)CC2=O)cc1
473693,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,20.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473694,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,20.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473695,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,60.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473696,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,30.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473697,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,20.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473698,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,60.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473699,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,30.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473700,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1,310.155,[M+H]+,20.0,val,O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccccn1
473701,CC(=O)N(C(C)=O)c1c(C)cc(N=Nc2ccccc2C)cc1,310.155,[M+H]+,20.0,val,CC(=O)N(C(C)=O)c1ccc(N=Nc2ccccc2C)cc1C
473702,CC(=O)N(C(C)=O)c1c(C)cc(N=Nc2ccccc2C)cc1,310.155,[M+H]+,20.0,val,CC(=O)N(C(C)=O)c1ccc(N=Nc2ccccc2C)cc1C
473703,CC(=O)N(C(C)=O)c1c(C)cc(N=Nc2ccccc2C)cc1,310.155,[M+H]+,60.0,val,CC(=O)N(C(C)=O)c1ccc(N=Nc2ccccc2C)cc1C
473704,CC(=O)N(C(C)=O)c1c(C)cc(N=Nc2ccccc2C)cc1,310.155,[M+H]+,30.0,val,CC(=O)N(C(C)=O)c1ccc(N=Nc2ccccc2C)cc1C
473705,CC(=O)N(C(C)=O)c1c(C)cc(N=Nc2ccccc2C)cc1,310.155,[M+H]+,20.0,val,CC(=O)N(C(C)=O)c1ccc(N=Nc2ccccc2C)cc1C
473706,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,308.14045,[M-H]-,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473707,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,308.14045,[M-H]-,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473708,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,308.14045,[M-H]-,60.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473709,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,308.14045,[M-H]-,30.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473710,NC(=O)c1nccc(OC2CN(C3Cc4ccccc4C3)C2)c1,310.155,[M+H]+,20.0,val,NC(=O)c1cc(OC2CN(C3Cc4ccccc4C3)C2)ccn1
473711,NC(=O)c1nccc(OC2CN(C3Cc4ccccc4C3)C2)c1,310.155,[M+H]+,20.0,val,NC(=O)c1cc(OC2CN(C3Cc4ccccc4C3)C2)ccn1
473712,NC(=O)c1nccc(OC2CN(C3Cc4ccccc4C3)C2)c1,310.155,[M+H]+,60.0,val,NC(=O)c1cc(OC2CN(C3Cc4ccccc4C3)C2)ccn1
473713,NC(=O)c1nccc(OC2CN(C3Cc4ccccc4C3)C2)c1,310.155,[M+H]+,30.0,val,NC(=O)c1cc(OC2CN(C3Cc4ccccc4C3)C2)ccn1
473714,NC(=O)c1nccc(OC2CN(C3Cc4ccccc4C3)C2)c1,310.155,[M+H]+,20.0,val,NC(=O)c1cc(OC2CN(C3Cc4ccccc4C3)C2)ccn1
473715,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473716,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473717,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,30.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473718,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,60.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473719,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,15.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473720,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473721,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,60.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473722,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473723,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,332.13694,[M+Na]+,45.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473724,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,332.13694,[M+Na]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473725,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,354.14593,[M+FA]-,15.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473726,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,354.14593,[M+FA]-,20.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473727,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,308.14045,[M-H]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473728,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,308.14045,[M-H]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473729,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,308.14045,[M-H]-,60.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473730,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,308.14045,[M-H]-,15.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473731,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,308.14045,[M-H]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473732,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,354.14593,[M+FA]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473733,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,354.14593,[M+FA]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473734,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,354.14593,[M+FA]-,15.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473735,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,354.14593,[M+FA]-,60.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473736,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,354.14593,[M+FA]-,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473737,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,308.14045,[M-H]-,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473738,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,308.14045,[M-H]-,60.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473739,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,308.14045,[M-H]-,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473740,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,308.14045,[M-H]-,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473741,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,308.14045,[M-H]-,60.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473742,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,344.11713,[M+Cl]-,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473743,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,344.11713,[M+Cl]-,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473744,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,344.11713,[M+Cl]-,60.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473745,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C,308.14045,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C
473746,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C,308.14045,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C
473747,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C,308.14045,[M-H]-,60.0,val,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C
473748,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C,308.14045,[M-H]-,15.0,val,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C
473749,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C,308.14045,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C#N)c2=O)cc1C
473750,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473751,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473752,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,45.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473753,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,60.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473754,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473755,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473756,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,45.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473757,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,308.14045,[M-H]-,60.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473758,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,344.11713,[M+Cl]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473759,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,344.11713,[M+Cl]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473760,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,354.14593,[M+FA]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473761,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,354.14593,[M+FA]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473762,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,354.14593,[M+FA]-,60.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473763,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,354.14593,[M+FA]-,15.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473764,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,354.14593,[M+FA]-,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473765,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473766,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473767,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,60.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473768,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,30.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473769,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473770,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473771,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,30.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473772,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,308.14045,[M-H]-,60.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473773,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,354.14593,[M+FA]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473774,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,354.14593,[M+FA]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473775,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,354.14593,[M+FA]-,60.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473776,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,354.14593,[M+FA]-,15.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473777,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,354.14593,[M+FA]-,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473778,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473779,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473780,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,45.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473781,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,60.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473782,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,45.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473783,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,308.14045,[M-H]-,60.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473784,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,354.14593,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473785,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,354.14593,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473786,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,354.14593,[M+FA]-,60.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473787,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,354.14593,[M+FA]-,15.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473788,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,354.14593,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473789,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473790,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473791,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,45.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473792,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473793,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473794,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,308.14045,[M-H]-,45.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473795,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,354.14593,[M+FA]-,15.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473796,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,354.14593,[M+FA]-,15.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473797,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,354.14593,[M+FA]-,60.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473798,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,354.14593,[M+FA]-,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473799,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,354.14593,[M+FA]-,15.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473800,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,308.14045,[M-H]-,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473801,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,308.14045,[M-H]-,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473802,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,354.14593,[M+FA]-,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473803,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,354.14593,[M+FA]-,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473804,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,354.14593,[M+FA]-,60.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473805,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,354.14593,[M+FA]-,15.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473806,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,354.14593,[M+FA]-,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473807,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,354.14593,[M+FA]-,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473808,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,354.14593,[M+FA]-,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473809,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,354.14593,[M+FA]-,60.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473810,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,354.14593,[M+FA]-,15.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473811,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,354.14593,[M+FA]-,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473812,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,308.14045,[M-H]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473813,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,308.14045,[M-H]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473814,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,308.14045,[M-H]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473815,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,308.14045,[M-H]-,60.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473816,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,308.14045,[M-H]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473817,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,344.11713,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473818,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,344.11713,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473819,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473820,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473821,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473822,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473823,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473824,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473825,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473826,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,354.14593,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473827,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,20.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473828,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,20.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473829,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,60.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473830,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,30.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473831,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,20.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473832,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,45.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473833,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,60.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473834,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1,310.155,[M+H]+,20.0,val,Cc1nc2c(O)cc(C(=O)N(C)C)cc2n1Cc1ccccc1
473835,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,310.155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473836,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,310.155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473837,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,310.155,[M+H]+,60.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473838,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,310.155,[M+H]+,30.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473839,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1,310.155,[M+H]+,20.0,val,O=C(NCC1CC(=O)N(Cc2ccccc2)C1)c1cccnc1
473840,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,310.155,[M+H]+,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473841,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,310.155,[M+H]+,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473842,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,310.155,[M+H]+,60.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473843,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,310.155,[M+H]+,30.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473844,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1,310.155,[M+H]+,20.0,val,COc1cccc(CCNC(=O)Nc2c[nH]c3ccccc23)c1
473845,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473846,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473847,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,60.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473848,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,15.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473849,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473850,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,60.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473851,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,15.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473852,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1,310.155,[M+H]+,20.0,val,O=C(N/N=C/c1ccccn1)c1ccc(OC2CCCC2)cc1
473853,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,20.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473854,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,20.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473855,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,45.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473856,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,60.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473857,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,20.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473858,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,45.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473859,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,60.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473860,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21,310.155,[M+H]+,20.0,val,Cn1c(C2CCCCN2C(=O)c2ccco2)nc2ccccc21
473861,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473862,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473863,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473864,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473865,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473866,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473867,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473868,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1,310.155,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc3ccccc3o2)CC1
473869,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473870,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473871,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,45.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473872,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,60.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473873,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473874,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,60.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473875,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,45.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473876,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1,310.155,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)NCc2ccc(C3CC3)nc2)cc1
473877,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473878,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473879,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,60.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473880,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,30.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473881,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473882,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,60.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473883,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,30.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473884,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1,310.155,[M+H]+,20.0,val,O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccncc1
473885,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473886,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473887,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,60.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473888,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,15.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473889,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473890,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473891,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,15.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473892,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1,310.155,[M+H]+,60.0,val,O=C(Cn1ncccc1=O)N1CC2(CC(c3ccccc3)C2)C1
473893,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473894,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473895,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,60.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473896,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,30.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473897,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473898,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473899,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,30.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473900,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O,310.155,[M+H]+,60.0,val,Cc1ccc(NC(=O)Nc2ccccc2)cc1N1CCCC1=O
473901,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,310.155,[M+H]+,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473902,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,310.155,[M+H]+,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473903,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,310.155,[M+H]+,60.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473904,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,310.155,[M+H]+,15.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473905,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12,310.155,[M+H]+,20.0,val,COc1ccccc1NC(=O)NCCc1c[nH]c2ccccc12
473906,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473907,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473908,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473909,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473910,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473911,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,30.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473912,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,60.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473913,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1,310.155,[M+H]+,20.0,val,Cc1ccc(-c2cc(N3CCN(C)CC3)c(C#N)c(=O)o2)cc1
473914,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473915,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473916,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,30.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473917,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,60.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473918,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473919,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,45.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473920,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,60.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473921,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC,310.155,[M+H]+,20.0,val,COc1ccc(CCNc2cnc3ccccc3n2)cc1OC
473922,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2,310.155,[M+H]+,20.0,val,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2
473923,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2,310.155,[M+H]+,20.0,val,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2
473924,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2,310.155,[M+H]+,45.0,val,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2
473925,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2,310.155,[M+H]+,60.0,val,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2
473926,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2,310.155,[M+H]+,20.0,val,O=C(NC1CCCc2ccccc21)c1cc2c(nn1)CCOC2
473927,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473928,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473929,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,60.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473930,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,30.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473931,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473932,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,60.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473933,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,30.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473934,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,310.155,[M+H]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473935,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473936,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473937,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,45.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473938,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,60.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473939,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473940,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,45.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473941,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,60.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473942,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21,332.13694,[M+Na]+,20.0,val,Cn1ccc2c(OCC(=O)NCCc3ccncc3)cccc21
473943,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,310.155,[M+H]+,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473944,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,310.155,[M+H]+,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473945,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,310.155,[M+H]+,60.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473946,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,310.155,[M+H]+,15.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473947,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1,310.155,[M+H]+,20.0,val,O=C(CC1Nc2ccccc2NC1=O)NCCc1ccccc1
473948,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,20.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473949,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,20.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473950,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,60.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473951,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,30.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473952,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,20.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473953,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,20.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473954,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,30.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473955,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1,310.155,[M+H]+,60.0,val,CCN(C(=O)Cn1c(CO)nc2ccccc21)c1ccccc1
473956,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,20.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473957,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,20.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473958,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,60.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473959,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,30.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473960,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,20.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473961,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,60.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473962,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,30.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473963,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1,310.155,[M+H]+,20.0,val,CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(c2cccnc2)C1
473964,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,310.155,[M+H]+,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473965,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,310.155,[M+H]+,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473966,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,310.155,[M+H]+,60.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473967,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,310.155,[M+H]+,30.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473968,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1,310.155,[M+H]+,20.0,val,Cc1c(NC(=O)Nc2ccccc2)cccc1NC(=O)C1CC1
473969,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,20.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473970,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,20.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473971,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,45.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473972,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,60.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473973,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,20.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473974,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,60.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473975,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,20.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473976,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1,310.155,[M+H]+,45.0,val,CCOc1ccc(/C=N/c2nc3ccccc3n2CC)c(O)c1
473977,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,20.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473978,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,20.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473979,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,60.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473980,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,30.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473981,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,20.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473982,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,60.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473983,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,30.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473984,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1,370.13322,[M+H]+,20.0,val,COc1ccccc1NC(=O)C1C(C)N=C2N=CNN2C1c1cccs1
473985,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,20.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473986,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,20.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473987,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,30.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473988,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,60.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473989,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,20.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473990,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,45.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473991,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,60.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473992,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O,370.15098,[M+H]+,20.0,val,CC(=O)C(C)n1c(=O)c2c(nc3n(Cc4ccco4)c(C)cn23)n(C)c1=O
473993,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473994,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473995,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473996,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473997,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,45.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473998,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,60.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
473999,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,20.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
474000,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1,344.0962,[M-H]-,45.0,val,Cc1cc(S(=O)(=O)NC(=O)C2CC23CCc2ccccc23)c(C)o1
474001,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474002,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474003,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,60.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474004,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,30.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474005,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474006,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,60.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474007,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,30.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474008,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1,344.0962,[M-H]-,20.0,val,O=C(O)c1cccc(CS(=O)(=O)N2CCC(c3ccccc3)C2)c1
474009,O=S(=O)(Nc1cccc2c1OCCC2)c1cc2c(cc1)OCCC2,346.11075,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2c1OCCC2)c1ccc2c(c1)CCCO2
474010,O=S(=O)(Nc1cccc2c1OCCC2)c1cc2c(cc1)OCCC2,346.11075,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2c1OCCC2)c1ccc2c(c1)CCCO2
474011,O=S(=O)(Nc1cccc2c1OCCC2)c1cc2c(cc1)OCCC2,346.11075,[M+H]+,60.0,val,O=S(=O)(Nc1cccc2c1OCCC2)c1ccc2c(c1)CCCO2
474012,O=S(=O)(Nc1cccc2c1OCCC2)c1cc2c(cc1)OCCC2,346.11075,[M+H]+,15.0,val,O=S(=O)(Nc1cccc2c1OCCC2)c1ccc2c(c1)CCCO2
474013,O=S(=O)(Nc1cccc2c1OCCC2)c1cc2c(cc1)OCCC2,346.11075,[M+H]+,20.0,val,O=S(=O)(Nc1cccc2c1OCCC2)c1ccc2c(c1)CCCO2
474014,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474015,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474016,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474017,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474018,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474019,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474020,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474021,Cc1cc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)ccc1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474022,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474023,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474024,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,60.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474025,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,30.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474026,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474027,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,30.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474028,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474029,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,344.0962,[M-H]-,60.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474030,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,344.0962,[M-H]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474031,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,344.0962,[M-H]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474032,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,344.0962,[M-H]-,60.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474033,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,344.0962,[M-H]-,30.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474034,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,344.0962,[M-H]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474035,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,390.10168,[M+FA]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474036,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,390.10168,[M+FA]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474037,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,390.10168,[M+FA]-,60.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474038,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,390.10168,[M+FA]-,15.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474039,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,390.10168,[M+FA]-,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474040,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474041,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474042,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474043,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474044,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474045,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,30.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474046,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474047,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,344.0962,[M-H]-,60.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474048,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,380.07288,[M+Cl]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474049,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,380.07288,[M+Cl]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474050,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,380.07288,[M+Cl]-,60.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474051,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,380.07288,[M+Cl]-,15.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474052,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1,380.07288,[M+Cl]-,20.0,val,Cc1cccc(S(=O)(=O)NCCC(O)c2cc3ccccc3o2)c1
474053,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474054,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474055,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474056,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474057,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474058,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474059,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474060,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,344.0962,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474061,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,380.07288,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474062,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,380.07288,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474063,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,380.07288,[M+Cl]-,60.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474064,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,380.07288,[M+Cl]-,15.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474065,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,380.07288,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474066,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,390.10168,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474067,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,390.10168,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474068,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,390.10168,[M+FA]-,60.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474069,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,390.10168,[M+FA]-,15.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474070,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,390.10168,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474071,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474072,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474073,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,60.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474074,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,30.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474075,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474076,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,30.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474077,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,60.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474078,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1,328.10019,[M+H-H2O]+,20.0,val,COC(=O)c1ccc(C(=O)NCC2(O)CCCc3sccc32)cc1
474079,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,346.11075,[M+H]+,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474080,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,346.11075,[M+H]+,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474081,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,346.11075,[M+H]+,60.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474082,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,346.11075,[M+H]+,15.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474083,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1,346.11075,[M+H]+,20.0,val,Cc1ccc(-c2ccc(S(=O)(=O)N3CCCC3C(=O)O)cc2)cc1
474084,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,346.11075,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474085,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,346.11075,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474086,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,346.11075,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474087,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,346.11075,[M+H]+,60.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474088,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1,346.11075,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)CCCS(=O)(=O)c2ccccc2)c1
474089,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474090,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474091,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,60.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474092,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,15.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474093,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474094,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,60.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474095,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,15.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474096,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,344.11396,[M-H]-,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474097,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,346.12851,[M+H]+,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474098,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,346.12851,[M+H]+,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474099,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,346.12851,[M+H]+,60.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474100,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,346.12851,[M+H]+,30.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474101,CCOc1c(CNC(=O)c2ccc(C(=O)O)o2)cc2OC(C)Cc2c1,346.12851,[M+H]+,20.0,val,CCOc1cc2c(cc1CNC(=O)c1ccc(C(=O)O)o1)OC(C)C2
474102,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)ccc1,346.12851,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1
474103,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)ccc1,346.12851,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1
474104,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)ccc1,346.12851,[M+H]+,60.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1
474105,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)ccc1,346.12851,[M+H]+,15.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1
474106,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)ccc1,346.12851,[M+H]+,20.0,val,COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1
474107,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474108,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474109,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474110,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,15.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474111,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474112,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,15.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474113,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474114,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,344.11396,[M-H]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474115,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,380.09064,[M+Cl]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474116,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,380.09064,[M+Cl]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474117,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,380.09064,[M+Cl]-,15.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474118,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,380.09064,[M+Cl]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474119,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,390.11944,[M+FA]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474120,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,390.11944,[M+FA]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474121,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,390.11944,[M+FA]-,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474122,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,390.11944,[M+FA]-,30.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474123,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,390.11944,[M+FA]-,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474124,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1,344.11396,[M-H]-,20.0,val,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1
474125,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1,344.11396,[M-H]-,20.0,val,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1
474126,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1,344.11396,[M-H]-,15.0,val,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1
474127,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1,344.11396,[M-H]-,60.0,val,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1
474128,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1,344.11396,[M-H]-,20.0,val,CCCOC(=O)c1ccc(NC(=O)C2C3C=CC(O3)C2C(=O)O)cc1
474129,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,328.11795,[M+H-H2O]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474130,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,328.11795,[M+H-H2O]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474131,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,328.11795,[M+H-H2O]+,30.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474132,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,328.11795,[M+H-H2O]+,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474133,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,328.11795,[M+H-H2O]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474134,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,346.12851,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474135,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,346.12851,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474136,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,346.12851,[M+H]+,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474137,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,346.12851,[M+H]+,15.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474138,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,346.12851,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474139,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,368.11046,[M+Na]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474140,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,368.11046,[M+Na]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474141,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,368.11046,[M+Na]+,60.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474142,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,368.11046,[M+Na]+,30.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474143,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1,368.11046,[M+Na]+,20.0,val,CC1=C(C(=O)OCC2CCCO2)C2(O)C(=O)c3ccccc3C2(O)N1
474144,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,454.06358,[M+FA]-,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474145,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,454.06358,[M+FA]-,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474146,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,454.06358,[M+FA]-,60.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474147,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,454.06358,[M+FA]-,15.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474148,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,454.06358,[M+FA]-,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474149,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474150,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474151,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,60.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474152,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,15.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474153,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474154,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,60.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474155,O=S1(=O)C[C@H](NCc2cc3c(cc2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1,410.07265,[M+H]+,20.0,val,O=S1(=O)C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](S(=O)(=O)c2ccccc2)C1
474156,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,369.09422,[M+Cl]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474157,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,369.09422,[M+Cl]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474158,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,369.09422,[M+Cl]-,60.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474159,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,369.09422,[M+Cl]-,15.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474160,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,369.09422,[M+Cl]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474161,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,379.12302,[M+FA]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474162,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,379.12302,[M+FA]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474163,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,379.12302,[M+FA]-,60.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474164,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,379.12302,[M+FA]-,15.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474165,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,379.12302,[M+FA]-,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474166,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474167,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474168,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,15.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474169,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,60.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474170,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,30.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474171,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474172,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,60.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474173,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1,335.13209,[M+H]+,20.0,val,CN(C)C(CNC(=O)Cc1ccc(Cl)cc1)c1ccc(F)cc1
474174,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,361.12369,[M-H]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474175,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,361.12369,[M-H]-,60.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474176,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,361.12369,[M-H]-,30.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474177,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,361.12369,[M-H]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474178,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474179,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474180,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,60.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474181,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,15.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474182,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474183,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,60.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474184,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,15.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474185,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,407.12917,[M+FA]-,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474186,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,397.10037,[M+Cl]-,15.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474187,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,397.10037,[M+Cl]-,60.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474188,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,407.12917,[M+FA]-,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474189,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,407.12917,[M+FA]-,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474190,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,407.12917,[M+FA]-,60.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474191,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,407.12917,[M+FA]-,15.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474192,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,407.12917,[M+FA]-,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474193,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,327.11712,[M+H-2H2O]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474194,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,327.11712,[M+H-2H2O]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474195,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,327.11712,[M+H-2H2O]+,60.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474196,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,327.11712,[M+H-2H2O]+,15.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474197,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,327.11712,[M+H-2H2O]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474198,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,363.13824,[M+H]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474199,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,363.13824,[M+H]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474200,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,363.13824,[M+H]+,60.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474201,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,363.13824,[M+H]+,30.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474202,Cn1ncc(C(=O)NC2CCN(c3cc(F)c(Cl)cc3)C2)c1C1CC1,363.13824,[M+H]+,20.0,val,Cn1ncc(C(=O)NC2CCN(c3ccc(Cl)c(F)c3)C2)c1C1CC1
474203,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474204,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474205,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,60.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474206,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474207,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,45.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474208,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,60.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474209,Cc1nnc2CCC(C(=O)NCC3(c4c(Cl)cc(F)cc4)CC3)Cn12,363.13824,[M+H]+,20.0,val,Cc1nnc2n1CC(C(=O)NCC1(c3ccc(F)cc3Cl)CC1)CC2
474210,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474211,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474212,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,30.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474213,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474214,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474215,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,45.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474216,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474217,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,398.13331,[M-H]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474218,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474219,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474220,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474221,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,15.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474222,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474223,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474224,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,15.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474225,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,434.10999,[M+Cl]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474226,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474227,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474228,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474229,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,15.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474230,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474231,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474232,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,15.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474233,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,444.13879,[M+FA]-,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474234,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474235,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474236,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474237,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,30.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474238,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474239,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,60.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474240,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,30.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474241,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC,400.14787,[M+H]+,20.0,val,COc1cc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc(OC)c1OC
474242,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474243,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474244,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,60.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474245,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,30.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474246,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474247,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,30.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474248,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,20.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474249,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,400.14787,[M+H]+,60.0,val,O=C(CN1C(=O)CCC1=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
474250,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474251,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474252,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474253,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474254,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474255,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474256,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474257,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,360.13651,[M-H]-,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474258,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474259,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474260,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474261,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474262,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474263,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474264,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474265,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474266,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474267,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474268,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474269,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474270,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474271,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,60.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474272,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,30.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474273,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1,362.15106,[M+H]+,20.0,val,COCC1(C(=O)O)CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1
474274,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474275,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474276,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474277,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474278,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474279,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12,362.15106,[M+H]+,20.0,val,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12
474280,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12,362.15106,[M+H]+,20.0,val,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12
474281,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12,362.15106,[M+H]+,60.0,val,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12
474282,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12,362.15106,[M+H]+,30.0,val,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12
474283,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12,362.15106,[M+H]+,20.0,val,CC[C@@H]1[C@H](F)C(=O)N[C@@H]1COc1nccc2cc(C(N)=O)c(OC)cc12
474284,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474285,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474286,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474287,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474288,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474289,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474290,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474291,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474292,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474293,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474294,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474295,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474296,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474297,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474298,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474299,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474300,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474301,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474302,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474303,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474304,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474305,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474306,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474307,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474308,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474309,CC1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474310,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474311,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474312,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474313,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474314,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474315,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,60.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474316,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,30.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474317,C[C@H]1COc2c3c(cc(F)c2N2CCN(C)CC2)c(=O)c(C(=O)O)cn31,362.15106,[M+H]+,20.0,val,C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
474318,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1,362.15106,[M+H]+,20.0,val,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1
474319,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1,362.15106,[M+H]+,20.0,val,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1
474320,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1,362.15106,[M+H]+,60.0,val,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1
474321,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1,362.15106,[M+H]+,30.0,val,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1
474322,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1,362.15106,[M+H]+,20.0,val,COC(=O)C1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2OC)CC1
474323,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474324,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474325,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,45.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474326,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,60.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474327,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474328,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,45.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474329,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474330,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,316.13545,[M-H]-,60.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474331,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21,362.14092,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21
474332,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21,362.14092,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21
474333,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21,362.14092,[M+FA]-,60.0,val,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21
474334,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21,362.14092,[M+FA]-,15.0,val,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21
474335,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21,362.14092,[M+FA]-,20.0,val,O=C(CCc1ccccc1F)NCC1(O)CCCc2occc21
474336,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474337,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474338,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,60.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474339,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,30.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474340,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474341,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,30.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474342,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,20.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474343,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1,318.15,[M+H]+,60.0,val,CC(=O)C1=C(O)C(=O)N(C2CCCCC2)C1c1ccc(F)cc1
474344,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,20.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474345,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,20.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474346,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,75.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474347,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,30.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474348,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,60.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474349,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,20.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474350,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,20.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474351,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1,318.15,[M+H]+,60.0,val,Cc1cc(C)cc(OCC(=O)NCCOc2ccc(F)cc2)c1
474352,CCOC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2)OCc2c-3onc2)CC1,393.11148,[M+H]+,20.0,val,CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)CC1
474353,CCOC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2)OCc2c-3onc2)CC1,393.11148,[M+H]+,20.0,val,CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)CC1
474354,CCOC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2)OCc2c-3onc2)CC1,393.11148,[M+H]+,60.0,val,CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)CC1
474355,CCOC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2)OCc2c-3onc2)CC1,393.11148,[M+H]+,30.0,val,CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)CC1
474356,CCOC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2)OCc2c-3onc2)CC1,393.11148,[M+H]+,20.0,val,CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)CC1
474357,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474358,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474359,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,60.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474360,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,30.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474361,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474362,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,60.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474363,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,30.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474364,CCOC(=O)Cc1csc(NC(=O)CSc2nc3c(c(C)c(C)s3)c(=O)n2C)n1,451.05739,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)CSc2nc3sc(C)c(C)c3c(=O)n2C)n1
474365,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,335.16258,[M-H]-,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474366,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,335.16258,[M-H]-,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474367,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,335.16258,[M-H]-,60.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474368,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,335.16258,[M-H]-,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474369,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,335.16258,[M-H]-,60.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474370,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,20.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474371,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,20.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474372,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,60.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474373,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,20.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474374,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,45.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474375,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,60.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474376,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,20.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474377,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12,337.17713,[M+H]+,45.0,val,Cc1cnc2cc(C(=O)NC3CCCN(c4ncccn4)C3)ccn12
474378,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,20.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474379,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,20.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474380,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,60.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474381,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,20.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474382,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,45.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474383,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,60.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474384,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,20.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474385,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21,337.17713,[M+H]+,45.0,val,CCn1cnc2c(Nc3ccc(N(C(C)=O)C4CC4)cc3)ncnc21
474386,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474387,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474388,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,60.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474389,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,30.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474390,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474391,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,60.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474392,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,30.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474393,Cc1ccccc1C(=O)NC1CCN(c2c3[nH]cnc3ncn2)CC1,337.17713,[M+H]+,20.0,val,Cc1ccccc1C(=O)NC1CCN(c2ncnc3nc[nH]c23)CC1
474394,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,20.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474395,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,20.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474396,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,60.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474397,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,30.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474398,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,20.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474399,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,60.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474400,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,30.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474401,COc1ccccc1-c1nnc(N2CCC(n3ccnn3)CC2)cc1,337.17713,[M+H]+,20.0,val,COc1ccccc1-c1ccc(N2CCC(n3ccnn3)CC2)nn1
474402,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474403,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474404,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474405,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,30.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474406,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474407,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474408,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,30.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474409,Cc1nn(-c2ncc(-c3noc(C4CC45CCNC5)n3)cc2)c(C)c1,337.17713,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccc(-c3noc(C4CC45CCNC5)n3)cn2)n1
474410,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,335.16258,[M-H]-,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474411,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,335.16258,[M-H]-,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474412,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,335.16258,[M-H]-,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474413,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,335.16258,[M-H]-,30.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474414,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,335.16258,[M-H]-,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474415,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3nccnc3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474416,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3nccnc3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474417,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3nccnc3)ncc12,337.17713,[M+H]+,60.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474418,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3nccnc3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474419,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3nccnc3)ncc12,337.17713,[M+H]+,45.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474420,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474421,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474422,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474423,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474424,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,45.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474425,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474426,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474427,CCN1CCc2c(cccc2NC(=O)c2nn3c(C)nnc3cc2)C1,337.17713,[M+H]+,45.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474428,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474429,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474430,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474431,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,30.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474432,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474433,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,30.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474434,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474435,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,335.16258,[M-H]-,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474436,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,371.13926,[M+Cl]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474437,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,371.13926,[M+Cl]-,15.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474438,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474439,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474440,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474441,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,15.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474442,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474443,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,15.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474444,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474445,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,381.16806,[M+FA]-,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474446,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474447,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474448,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,45.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474449,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,60.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474450,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474451,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,45.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474452,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,60.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474453,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,335.16258,[M-H]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474454,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,381.16806,[M+FA]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474455,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,381.16806,[M+FA]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474456,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,381.16806,[M+FA]-,60.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474457,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,381.16806,[M+FA]-,15.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474458,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,381.16806,[M+FA]-,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474459,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,381.16806,[M+FA]-,60.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474460,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,381.16806,[M+FA]-,15.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474461,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,381.16806,[M+FA]-,20.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474462,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474463,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474464,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,30.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474465,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474466,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474467,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,45.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474468,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,60.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474469,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474470,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1,337.17713,[M+H]+,45.0,val,Cc1ccc(N2CC(N(C)C(=O)c3nn(C)c4ccccc34)C2)nn1
474471,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474472,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474473,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,30.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474474,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474475,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474476,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,45.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474477,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,60.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474478,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1,337.17713,[M+H]+,20.0,val,Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccn2)n1
474479,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,337.17713,[M+H]+,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474480,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,337.17713,[M+H]+,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474481,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,337.17713,[M+H]+,60.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474482,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,337.17713,[M+H]+,15.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474483,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1,337.17713,[M+H]+,20.0,val,CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1
474484,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474485,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474486,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474487,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,15.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474488,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474489,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474490,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,15.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474491,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,301.15601,[M+H-2H2O]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474492,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474493,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474494,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,45.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474495,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474496,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474497,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,45.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474498,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,20.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474499,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1,337.17713,[M+H]+,60.0,val,CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1
474500,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474501,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474502,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,60.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474503,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,30.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474504,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474505,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,45.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474506,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,60.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474507,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1,337.17713,[M+H]+,20.0,val,Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1
474508,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,20.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474509,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,20.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474510,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,60.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474511,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,15.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474512,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,20.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474513,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,60.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474514,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,20.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474515,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1,337.17713,[M+H]+,15.0,val,Cc1ccnc(OCC23CCCC2CN(c2nccc(C#N)n2)C3)n1
474516,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,20.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474517,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,20.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474518,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,60.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474519,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,20.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474520,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,20.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474521,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21,337.17713,[M+H]+,60.0,val,Cc1ccccc1-n1ncc2c(N3CCC(C(N)=O)CC3)ncnc21
474522,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,20.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474523,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,20.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474524,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,45.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474525,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,60.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474526,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,20.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474527,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,45.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474528,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,60.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474529,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1,337.17713,[M+H]+,20.0,val,CC(=O)N1CCCN(c2cc(-c3ccccc3)nc3ncnn23)CC1
474530,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474531,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474532,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,30.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474533,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,60.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474534,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474535,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,45.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474536,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,60.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474537,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12,337.17713,[M+H]+,20.0,val,Cc1cc(=O)n(C2CCCC2)c2nc(NCc3cnccn3)ncc12
474538,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474539,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474540,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,60.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474541,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474542,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,45.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474543,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,60.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474544,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,20.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474545,CCS(=O)(=O)N1CCc2c(cc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2)C1,427.05585,[M-H]-,45.0,val,CCS(=O)(=O)N1CCc2ccc(NS(=O)(=O)Cc3ccc(Cl)cc3)cc2C1
474546,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,20.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474547,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,20.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474548,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,45.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474549,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,60.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474550,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,20.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474551,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,45.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474552,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,60.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474553,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1,427.05585,[M-H]-,20.0,val,Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)c(N3CCCS3(=O)=O)c2)c(C)c1
474554,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,20.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474555,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,20.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474556,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,60.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474557,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,30.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474558,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,20.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474559,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,60.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474560,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,30.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474561,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1,329.15275,[M+H]+,20.0,val,Clc1ccc2nc(N3CC(N4CC5CCCC5C4)C3)cnc2c1
474562,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,375.12294,[M-H]-,20.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474563,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,375.12294,[M-H]-,20.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474564,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,375.12294,[M-H]-,60.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474565,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,375.12294,[M-H]-,15.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474566,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,375.12294,[M-H]-,20.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474567,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,421.12842,[M+FA]-,20.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474568,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,421.12842,[M+FA]-,20.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474569,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,421.12842,[M+FA]-,60.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474570,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,421.12842,[M+FA]-,15.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474571,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,421.12842,[M+FA]-,20.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474572,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,377.13749,[M+H]+,15.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474573,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,377.13749,[M+H]+,15.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474574,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,377.13749,[M+H]+,20.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474575,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,377.13749,[M+H]+,60.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474576,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1,377.13749,[M+H]+,15.0,val,Cc1cc(C2CCCN2C(=O)CNC(=O)NCc2ccc(Cl)cc2)no1
474577,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,377.13749,[M+H]+,30.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474578,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,377.13749,[M+H]+,30.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474579,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,377.13749,[M+H]+,20.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474580,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,377.13749,[M+H]+,60.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474581,Cc1nnc2CN(C(=O)CC(C)Cc3ccc(Cl)cc3)C(C(=O)O)Cn12,377.13749,[M+H]+,30.0,val,Cc1nnc2n1CC(C(=O)O)N(C(=O)CC(C)Cc1ccc(Cl)cc1)C2
474582,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,394.15839,[M+FA]-,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474583,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,394.15839,[M+FA]-,60.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474584,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,394.15839,[M+FA]-,15.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474585,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,394.15839,[M+FA]-,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474586,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,348.15291,[M-H]-,20.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474587,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,348.15291,[M-H]-,20.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474588,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,348.15291,[M-H]-,60.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474589,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,348.15291,[M-H]-,30.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474590,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,348.15291,[M-H]-,20.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474591,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,30.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474592,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,30.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474593,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,20.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474594,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,60.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474595,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,30.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474596,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,20.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474597,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,60.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474598,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1,350.16746,[M+H]+,30.0,val,CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)C1CCC(F)(F)CC1
474599,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474600,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474601,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474602,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474603,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,45.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474604,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,60.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474605,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,20.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474606,Cc1nn(C)c(C)c1C(=O)NC1(c2c(F)cc(F)cc2)CCOCC1,350.16746,[M+H]+,45.0,val,Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
474607,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474608,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474609,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,60.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474610,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474611,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,45.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474612,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,60.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474613,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,20.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474614,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2c(F)cc(F)cc2)C1,350.16746,[M+H]+,45.0,val,CC1(O)CN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)C1
474615,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,348.15291,[M-H]-,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474616,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,348.15291,[M-H]-,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474617,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,348.15291,[M-H]-,20.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474618,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,348.15291,[M-H]-,60.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474619,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,348.15291,[M-H]-,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474620,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,394.15839,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474621,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,394.15839,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474622,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,394.15839,[M+FA]-,60.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474623,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,394.15839,[M+FA]-,15.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474624,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,394.15839,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474625,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,350.16746,[M+H]+,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474626,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,350.16746,[M+H]+,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474627,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,350.16746,[M+H]+,60.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474628,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,350.16746,[M+H]+,20.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474629,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1,350.16746,[M+H]+,30.0,val,O=C(CCc1ccccc1)NCc1nc(C2CCC(F)(F)CC2)no1
474630,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1,350.16746,[M+H]+,20.0,val,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1
474631,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1,350.16746,[M+H]+,20.0,val,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1
474632,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1,350.16746,[M+H]+,60.0,val,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1
474633,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1,350.16746,[M+H]+,15.0,val,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1
474634,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1,350.16746,[M+H]+,20.0,val,Cn1cccc1C(CNC(=O)c1c(F)cccc1F)N1CCOCC1
474635,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474636,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474637,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,45.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474638,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474639,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474640,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,45.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474641,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474642,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,396.11989,[M-H]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474643,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,432.09657,[M+Cl]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474644,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,432.09657,[M+Cl]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474645,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,432.09657,[M+Cl]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474646,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,432.09657,[M+Cl]-,15.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474647,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474648,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474649,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474650,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,15.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474651,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474652,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474653,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,15.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474654,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,442.12537,[M+FA]-,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474655,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474656,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474657,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,45.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474658,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474659,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474660,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,45.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474661,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,60.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474662,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O,398.13444,[M+H]+,20.0,val,CC(C)CN1CCn2cc(S(=O)(=O)NCc3ccc(F)cc3F)cc2C1=O
474663,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,20.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474664,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,20.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474665,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,60.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474666,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,30.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474667,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,20.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474668,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,60.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474669,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,30.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474670,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1,333.1609,[M+H]+,20.0,val,Cn1c(C(=O)N2CCOCC2CCO)ccc1-c1ccc(F)cc1
474671,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474672,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474673,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,60.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474674,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,30.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474675,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474676,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,60.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474677,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,30.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474678,O=C(C1CCCOC1)N1CCC(c2noc3c2ccc(F)c3)CC1,333.1609,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(c2noc3cc(F)ccc23)CC1
474679,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474680,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474681,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474682,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,30.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474683,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474684,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474685,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,30.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474686,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,331.14634,[M-H]-,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474687,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,367.12302,[M+Cl]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474688,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,367.12302,[M+Cl]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474689,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,367.12302,[M+Cl]-,15.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474690,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,367.12302,[M+Cl]-,15.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474691,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474692,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474693,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474694,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,15.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474695,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474696,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474697,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,15.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474698,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,377.15182,[M+FA]-,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474699,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474700,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474701,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,30.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474702,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474703,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474704,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,45.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474705,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,60.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474706,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C,333.1609,[M+H]+,20.0,val,Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C
474707,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C,333.14314,[M+H]+,20.0,val,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C
474708,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C,333.14314,[M+H]+,20.0,val,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C
474709,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C,333.14314,[M+H]+,60.0,val,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C
474710,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C,333.14314,[M+H]+,15.0,val,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C
474711,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C,333.14314,[M+H]+,20.0,val,Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC2)c1C
474712,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474713,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474714,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,60.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474715,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474716,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474717,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,60.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474718,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474719,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,371.16373,[M-H]-,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474720,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,417.1692,[M+FA]-,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474721,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,417.1692,[M+FA]-,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474722,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,417.1692,[M+FA]-,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474723,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,417.1692,[M+FA]-,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474724,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474725,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474726,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,30.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474727,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,60.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474728,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,15.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474729,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474730,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,60.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474731,Cn1ncc2c1nc(NCC(c1ccc(F)cc1)N1CCOCC1)[nH]c2=O,373.17828,[M+H]+,20.0,val,Cn1ncc2c(=O)[nH]c(NCC(c3ccc(F)cc3)N3CCOCC3)nc21
474732,O=C(NCC1CNC1)c1c(S(=O)(=O)N2CCc3ccccc3C2)ccs1,392.10971,[M+H]+,20.0,val,O=C(NCC1CNC1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1
474733,O=C(NCC1CNC1)c1c(S(=O)(=O)N2CCc3ccccc3C2)ccs1,392.10971,[M+H]+,20.0,val,O=C(NCC1CNC1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1
474734,O=C(NCC1CNC1)c1c(S(=O)(=O)N2CCc3ccccc3C2)ccs1,392.10971,[M+H]+,60.0,val,O=C(NCC1CNC1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1
474735,O=C(NCC1CNC1)c1c(S(=O)(=O)N2CCc3ccccc3C2)ccs1,392.10971,[M+H]+,30.0,val,O=C(NCC1CNC1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1
474736,O=C(NCC1CNC1)c1c(S(=O)(=O)N2CCc3ccccc3C2)ccs1,392.10971,[M+H]+,20.0,val,O=C(NCC1CNC1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1
474737,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,390.09516,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474738,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,390.09516,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474739,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,390.09516,[M-H]-,45.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474740,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,390.09516,[M-H]-,60.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474741,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,390.09516,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474742,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474743,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474744,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474745,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474746,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474747,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474748,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474749,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1,392.10971,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCCC2C(=O)Nc2nc3c(s2)CCC3)cc1
474750,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,20.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474751,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,20.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474752,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,60.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474753,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,20.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474754,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,45.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474755,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,60.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474756,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,20.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474757,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1,308.18697,[M+H]+,45.0,val,Cc1cc(CNc2ccc(C)c(C#N)n2)cc(N2CCCC2)n1
474758,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474759,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474760,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474761,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,45.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474762,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474763,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474764,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474765,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474766,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,45.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474767,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474768,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474769,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474770,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474771,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,306.17242,[M-H]-,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474772,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474773,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474774,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,30.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474775,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474776,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474777,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,306.17242,[M-H]-,30.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474778,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474779,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474780,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,45.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474781,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474782,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474783,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,60.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474784,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,20.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474785,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12,308.18697,[M+H]+,45.0,val,CC(C)N1CC(C)(C)N=C1C(C#N)c1cnnc2ccccc12
474786,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,308.18697,[M+H]+,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474787,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,308.18697,[M+H]+,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474788,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,308.18697,[M+H]+,60.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474789,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,308.18697,[M+H]+,15.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474790,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1,308.18697,[M+H]+,20.0,val,Cc1ccc(C(CNc2ncnc3ncccc23)N(C)C)cc1
474791,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,20.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474792,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,20.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474793,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,45.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474794,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,60.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474795,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,20.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474796,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,20.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474797,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,60.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474798,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1,308.18697,[M+H]+,45.0,val,c1cnc2nc(C3CCN(CCn4cccn4)CC3)ccc2c1
474799,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,20.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474800,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,20.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474801,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,75.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474802,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,60.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474803,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,20.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474804,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,20.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474805,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1,308.18697,[M+H]+,60.0,val,Cc1cc(N2CCCCC2C)n2nc(-c3ccccc3)nc2n1
474806,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474807,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474808,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,60.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474809,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474810,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,45.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474811,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,60.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474812,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474813,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,338.16225,[M-H]-,45.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474814,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474815,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474816,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,60.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474817,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474818,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,45.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474819,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,60.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474820,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474821,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,338.16225,[M-H]-,45.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474822,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,374.13893,[M+Cl]-,15.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474823,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,374.13893,[M+Cl]-,15.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474824,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,374.13893,[M+Cl]-,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474825,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,374.13893,[M+Cl]-,60.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474826,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,374.13893,[M+Cl]-,15.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474827,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,338.16225,[M-H]-,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474828,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,338.16225,[M-H]-,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474829,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,338.16225,[M-H]-,60.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474830,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,338.16225,[M-H]-,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474831,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,338.16225,[M-H]-,45.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474832,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474833,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474834,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,60.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474835,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,30.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474836,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474837,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,60.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474838,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,30.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474839,COc1c(OC2CCCC2)cc(Nc2c3ncn(C)c3ncn2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(Nc2ncnc3c2ncn3C)cc1OC1CCCC1
474840,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,20.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474841,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,20.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474842,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,30.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474843,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,60.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474844,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,20.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474845,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,45.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474846,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,60.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474847,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1,340.1768,[M+H]+,20.0,val,Cn1cc(-c2ccc(C(=O)N3CCC(c4ccnn4C)CC3)o2)cn1
474848,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,20.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474849,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,20.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474850,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,60.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474851,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,20.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474852,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,45.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474853,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,60.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474854,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,20.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474855,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2,340.1768,[M+H]+,45.0,val,CN1C(=O)N(c2ccnn2Cc2ccccn2)C(=O)C12CCCCC2
474856,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474857,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474858,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,60.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474859,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,30.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474860,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474861,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,60.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474862,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,30.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474863,O=C(Cc1c[nH]c2c1nccc2)N[C@@H]1CC(Cn2cccn2)C[C@H]1O,340.1768,[M+H]+,20.0,val,O=C(Cc1c[nH]c2cccnc12)N[C@@H]1CC(Cn2cccn2)C[C@H]1O
474864,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,20.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474865,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,20.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474866,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,60.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474867,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,30.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474868,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,20.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474869,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,60.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474870,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,30.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474871,C=CCNC(=O)CN1CCN(C(=O)c2c3ncccc3ccn2)CC1,340.1768,[M+H]+,20.0,val,C=CCNC(=O)CN1CCN(C(=O)c2nccc3cccnc23)CC1
474872,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474873,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474874,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,30.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474875,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,60.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474876,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474877,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,45.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474878,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,60.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474879,COc1ccc(C2(CNc3c4cn[nH]c4ncn3)CCOCC2)cc1,340.1768,[M+H]+,20.0,val,COc1ccc(C2(CNc3ncnc4[nH]ncc34)CCOCC2)cc1
474880,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474881,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474882,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,30.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474883,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,60.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474884,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474885,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,45.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474886,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,60.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474887,COc1c2ncnc(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)c2ccc1,340.1768,[M+H]+,20.0,val,COc1cccc2c(N[C@@H]3CC(Cn4ccnc4)C[C@H]3O)ncnc12
474888,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,20.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474889,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,20.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474890,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,60.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474891,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,20.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474892,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,45.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474893,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,60.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474894,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,20.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474895,CCCN(CC1COc2ccccc2O1)c1c2ncn(C)c2ncn1,340.1768,[M+H]+,45.0,val,CCCN(CC1COc2ccccc2O1)c1ncnc2c1ncn2C
474896,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,20.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474897,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,20.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474898,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,60.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474899,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,30.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474900,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,20.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474901,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,60.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474902,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,30.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474903,CN(C)CCCNc1nc2c(-c3cc4c(cc3)OCO4)cnn2cc1,340.1768,[M+H]+,20.0,val,CN(C)CCCNc1ccn2ncc(-c3ccc4c(c3)OCO4)c2n1
474904,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474905,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474906,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,60.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474907,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,15.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474908,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474909,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474910,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474911,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,60.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474912,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,30.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474913,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474914,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,60.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474915,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,30.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474916,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474917,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474918,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474919,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,60.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474920,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,30.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474921,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474922,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,60.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474923,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,30.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474924,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O,340.1768,[M+H]+,20.0,val,Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2ccccc2C#N)c1=O
474925,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474926,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474927,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,60.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474928,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,30.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474929,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474930,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,60.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474931,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,30.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474932,CCOc1nn2c(CNC(=O)CCc3cccc(C)c3)nnc2cc1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1
474933,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,338.16225,[M-H]-,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474934,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,338.16225,[M-H]-,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474935,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,338.16225,[M-H]-,45.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474936,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,338.16225,[M-H]-,60.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474937,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,338.16225,[M-H]-,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474938,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474939,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474940,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474941,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474942,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,30.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474943,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474944,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474945,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,338.16225,[M-H]-,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474946,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,374.13893,[M+Cl]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474947,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,374.13893,[M+Cl]-,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474948,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,374.13893,[M+Cl]-,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474949,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474950,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474951,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474952,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474953,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474954,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474955,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474956,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,384.16773,[M+FA]-,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
474957,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474958,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474959,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474960,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,30.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474961,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474962,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474963,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,30.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474964,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,338.16225,[M-H]-,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474965,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,374.13893,[M+Cl]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474966,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,374.13893,[M+Cl]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474967,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,374.13893,[M+Cl]-,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474968,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,374.13893,[M+Cl]-,15.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474969,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,374.13893,[M+Cl]-,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
474970,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474971,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474972,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,45.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474973,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,60.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474974,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474975,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,45.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474976,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,60.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474977,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,338.16225,[M-H]-,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474978,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,340.1768,[M+H]+,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474979,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,340.1768,[M+H]+,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474980,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,340.1768,[M+H]+,60.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474981,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,340.1768,[M+H]+,30.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474982,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1,340.1768,[M+H]+,20.0,val,CCc1ccc(CN(C(C)=O)c2nc3nc(C)c(C)c(=O)n3[nH]2)cc1
474983,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,340.1768,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474984,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,340.1768,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474985,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,340.1768,[M+H]+,60.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474986,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,340.1768,[M+H]+,30.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474987,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1,340.1768,[M+H]+,20.0,val,C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1
474988,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,20.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474989,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,20.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474990,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,60.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474991,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,15.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474992,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,20.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474993,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,20.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474994,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,15.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474995,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1,340.1768,[M+H]+,60.0,val,Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1
474996,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,321.15842,[M-H2O]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
474997,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,321.15842,[M-H2O]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
474998,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,321.15842,[M-H2O]+,60.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
474999,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,321.15842,[M-H2O]+,15.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475000,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,321.15842,[M-H2O]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475001,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,340.1768,[M+H]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475002,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,340.1768,[M+H]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475003,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,340.1768,[M+H]+,60.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475004,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,340.1768,[M+H]+,20.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475005,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1,340.1768,[M+H]+,60.0,val,Cc1cc(C)cc(N2CC(C)Cn3c2nc2c3c(=O)[nH]c(=O)n2C)c1
475006,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1
475007,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1
475008,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1,340.1768,[M+H]+,60.0,val,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1
475009,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1,340.1768,[M+H]+,15.0,val,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1
475010,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCCC1c1nc(-c2cccnc2)no1
475011,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475012,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475013,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475014,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475015,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475016,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,60.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475017,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,20.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475018,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1,340.1768,[M+H]+,15.0,val,CCOc1cc(CNc2nnnn2C)ccc1OCc1ccccc1
475019,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475020,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475021,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,30.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475022,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475023,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,15.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475024,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475025,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475026,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,322.16624,[M+H-H2O]+,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475027,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475028,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475029,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475030,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,15.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475031,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475032,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,60.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475033,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,20.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475034,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1,340.1768,[M+H]+,15.0,val,CCOc1cccc(CNc2nn[nH]n2)c1OCc1ccc(C)cc1
475035,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475036,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475037,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,60.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475038,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475039,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,60.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475040,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1,340.1768,[M+H]+,20.0,val,CCOc1ccc2nc(Nc3nc(=O)c(CC)c(C)[nH]3)nc(C)c2c1
475041,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475042,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475043,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,60.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475044,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,30.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475045,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475046,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,30.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475047,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,20.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475048,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1,340.1768,[M+H]+,60.0,val,Cc1noc(C)c1CN1CCCC(c2nc(-c3ccncc3)no2)C1
475049,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1,340.1768,[M+H]+,20.0,val,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1
475050,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1,340.1768,[M+H]+,20.0,val,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1
475051,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1,340.1768,[M+H]+,60.0,val,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1
475052,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1,340.1768,[M+H]+,15.0,val,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1
475053,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1,340.1768,[M+H]+,20.0,val,CCn1cccc1-c1noc(CNC(=O)c2ccc(N(C)C)cc2)n1
475054,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475055,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475056,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,60.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475057,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475058,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,45.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475059,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,60.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475060,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475061,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,370.15208,[M-H]-,45.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475062,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,416.15756,[M+FA]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475063,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,416.15756,[M+FA]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475064,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,416.15756,[M+FA]-,60.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475065,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,416.15756,[M+FA]-,15.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475066,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,416.15756,[M+FA]-,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475067,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,370.15208,[M-H]-,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475068,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,370.15208,[M-H]-,30.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475069,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,416.15756,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475070,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,416.15756,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475071,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,416.15756,[M+FA]-,60.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475072,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,416.15756,[M+FA]-,15.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475073,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,416.15756,[M+FA]-,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475074,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,372.16663,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475075,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,372.16663,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475076,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,372.16663,[M+H]+,60.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475077,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,372.16663,[M+H]+,15.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475078,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1cc2c(cc1)OCO2,372.16663,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(Cn2ccnn2)CC1)c1ccc2c(c1)OCO2
475079,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,372.16663,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475080,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,372.16663,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475081,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,372.16663,[M+H]+,60.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475082,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,372.16663,[M+H]+,15.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475083,Cc1noc(C2CCN(C(=O)Nc3cc4c(cc3)OC(C)C(=O)N4)CC2)n1,372.16663,[M+H]+,20.0,val,Cc1noc(C2CCN(C(=O)Nc3ccc4c(c3)NC(=O)C(C)O4)CC2)n1
475084,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,416.15756,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475085,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,416.15756,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475086,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,416.15756,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475087,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,416.15756,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475088,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,416.15756,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475089,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,372.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475090,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,372.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475091,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,372.16663,[M+H]+,60.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475092,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,372.16663,[M+H]+,30.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475093,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,372.16663,[M+H]+,20.0,val,OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O
475094,CCN1C(=O)COc2c1ccc(-c1noc(C(=O)N3CCN(C)CC3)n1)c2,372.16663,[M+H]+,20.0,val,CCN1C(=O)COc2cc(-c3noc(C(=O)N4CCN(C)CC4)n3)ccc21
475095,CCN1C(=O)COc2c1ccc(-c1noc(C(=O)N3CCN(C)CC3)n1)c2,372.16663,[M+H]+,20.0,val,CCN1C(=O)COc2cc(-c3noc(C(=O)N4CCN(C)CC4)n3)ccc21
475096,CCN1C(=O)COc2c1ccc(-c1noc(C(=O)N3CCN(C)CC3)n1)c2,372.16663,[M+H]+,60.0,val,CCN1C(=O)COc2cc(-c3noc(C(=O)N4CCN(C)CC4)n3)ccc21
475097,CCN1C(=O)COc2c1ccc(-c1noc(C(=O)N3CCN(C)CC3)n1)c2,372.16663,[M+H]+,30.0,val,CCN1C(=O)COc2cc(-c3noc(C(=O)N4CCN(C)CC4)n3)ccc21
475098,CCN1C(=O)COc2c1ccc(-c1noc(C(=O)N3CCN(C)CC3)n1)c2,372.16663,[M+H]+,20.0,val,CCN1C(=O)COc2cc(-c3noc(C(=O)N4CCN(C)CC4)n3)ccc21
475099,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475100,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475101,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,45.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475102,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475103,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475104,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,60.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475105,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,45.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475106,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,498.04036,[M-H]-,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475107,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,500.05491,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475108,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,500.05491,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475109,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,500.05491,[M+H]+,60.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475110,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,500.05491,[M+H]+,30.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475111,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1,500.05491,[M+H]+,20.0,val,CCSc1nnc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)sc(=O)n4C)CC2)s1
475112,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cc(Cl)ccc4)CC3)N=CN21,408.12555,[M+H]+,20.0,val,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cccc(Cl)c4)CC3)N=CN21
475113,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cc(Cl)ccc4)CC3)N=CN21,408.12555,[M+H]+,20.0,val,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cccc(Cl)c4)CC3)N=CN21
475114,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cc(Cl)ccc4)CC3)N=CN21,408.12555,[M+H]+,60.0,val,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cccc(Cl)c4)CC3)N=CN21
475115,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cc(Cl)ccc4)CC3)N=CN21,408.12555,[M+H]+,20.0,val,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cccc(Cl)c4)CC3)N=CN21
475116,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cc(Cl)ccc4)CC3)N=CN21,408.12555,[M+H]+,45.0,val,CC1CN=C2C=C(N3CCN(S(=O)(=O)Cc4cccc(Cl)c4)CC3)N=CN21
475117,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,370.17971,[M-H]-,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475118,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,370.17971,[M-H]-,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475119,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,370.17971,[M-H]-,60.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475120,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,370.17971,[M-H]-,30.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475121,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,370.17971,[M-H]-,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475122,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,372.19426,[M+H]+,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475123,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,372.19426,[M+H]+,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475124,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,372.19426,[M+H]+,60.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475125,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,372.19426,[M+H]+,20.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475126,Cc1nc2ccnn2c(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)c1,372.19426,[M+H]+,45.0,val,Cc1cc(N(C)C2CN(c3nc(C(C)C)c(F)c(=O)[nH]3)C2)n2nccc2n1
475127,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475128,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475129,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,60.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475130,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,30.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475131,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475132,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475133,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475134,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,60.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475135,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,30.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475136,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475137,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,60.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475138,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,30.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475139,CNCCCN1c2ccccc2CCc2ccccc21,267.18557,[M+H]+,20.0,val,CNCCCN1c2ccccc2CCc2ccccc21
475140,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475141,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475142,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,60.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475143,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,30.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475144,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475145,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,60.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475146,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,30.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475147,CCOc1ccccc1C(=O)NCCN1CCc2c(ccs2)C1,331.14747,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCCN1CCc2sccc2C1
475148,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,20.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475149,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,20.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475150,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,60.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475151,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,20.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475152,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,45.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475153,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,60.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475154,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,20.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475155,Cc1cc(OCC(=O)N(C)C2CCCc3c2sc(C)n3)ccc1,331.14747,[M+H]+,45.0,val,Cc1cccc(OCC(=O)N(C)C2CCCc3nc(C)sc32)c1
475156,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,20.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475157,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,20.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475158,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,60.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475159,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,30.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475160,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,20.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475161,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,60.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475162,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,30.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475163,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1,331.14747,[M+H]+,20.0,val,COc1cccc(N(C)C(=S)Oc2cccc(C(C)(C)C)c2)n1
475164,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475165,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475166,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,60.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475167,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,30.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475168,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475169,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,60.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475170,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,30.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475171,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475172,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475173,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475174,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,60.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475175,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,30.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475176,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475177,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,60.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475178,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,30.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475179,CCOC(=O)C(C#N)(CCN(C)C)c1csc2c1cc(C)cc2,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475180,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,329.13292,[M-H]-,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475181,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,329.13292,[M-H]-,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475182,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,329.13292,[M-H]-,45.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475183,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,329.13292,[M-H]-,60.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475184,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,329.13292,[M-H]-,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475185,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,329.13292,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475186,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,329.13292,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475187,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,329.13292,[M-H]-,60.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475188,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,329.13292,[M-H]-,30.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475189,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,329.13292,[M-H]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475190,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,375.1384,[M+FA]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475191,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,375.1384,[M+FA]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475192,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,375.1384,[M+FA]-,60.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475193,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,375.1384,[M+FA]-,15.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475194,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,375.1384,[M+FA]-,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475195,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475196,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475197,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,45.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475198,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,60.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475199,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475200,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475201,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,45.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475202,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,329.13292,[M-H]-,60.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475203,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475204,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475205,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475206,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,30.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475207,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475208,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,30.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475209,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475210,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,329.13292,[M-H]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475211,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,15.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475212,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475213,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475214,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,15.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475215,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,15.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475216,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475217,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,365.1096,[M+Cl]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475218,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475219,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475220,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475221,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,15.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475222,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475223,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,15.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475224,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475225,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,375.1384,[M+FA]-,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475226,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1,331.14747,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1
475227,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1,331.14747,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1
475228,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1,331.14747,[M+H]+,60.0,val,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1
475229,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1,331.14747,[M+H]+,30.0,val,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1
475230,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1,331.14747,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2ccco2)N3)C1
475231,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475232,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475233,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475234,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,30.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475235,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475236,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,20.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475237,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,30.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475238,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1,331.14747,[M+H]+,60.0,val,Cc1ccccc1NC(=O)NCC1(c2cccs2)CCOCC1
475239,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,331.14747,[M+H]+,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475240,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,331.14747,[M+H]+,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475241,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,331.14747,[M+H]+,60.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475242,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,331.14747,[M+H]+,30.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475243,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O,331.14747,[M+H]+,20.0,val,Cc1c(Cc2ccccc2)sc(NC(=O)C(C)(C)C)c1C(N)=O
475244,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,20.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475245,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,20.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475246,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,15.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475247,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,60.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475248,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,30.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475249,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,20.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475250,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,60.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475251,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1,331.14747,[M+H]+,20.0,val,CC1CN(Cc2ccc(NC(=O)c3cccs3)cc2)CC(C)O1
475252,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475253,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475254,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,60.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475255,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,30.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475256,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475257,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,30.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475258,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,60.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475259,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1,331.14747,[M+H]+,20.0,val,CCCCOc1cccc(/C=N/NC(=O)c2csc(C)c2C)c1
475260,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,20.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475261,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,20.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475262,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,60.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475263,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,30.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475264,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,20.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475265,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,60.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475266,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,30.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475267,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1,331.14747,[M+H]+,20.0,val,O=C(NCc1nc(C2CCCCC2)cs1)OCc1ccccc1
475268,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,20.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475269,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,20.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475270,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,60.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475271,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,30.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475272,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,20.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475273,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,30.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475274,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,60.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475275,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1,331.14747,[M+H]+,20.0,val,CCOc1ccc(NC(=O)N2CCC(c3cccs3)CC2)cc1
475276,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,20.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475277,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,20.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475278,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,60.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475279,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,30.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475280,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,20.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475281,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,60.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475282,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,30.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475283,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21,331.14747,[M+H]+,20.0,val,CCN1CCCc2cc(C(=O)NCc3cccc(OC)c3)sc21
475284,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475285,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475286,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,30.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475287,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,60.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475288,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475289,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,45.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475290,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,60.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475291,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12,331.14747,[M+H]+,20.0,val,CCOC(=O)C(C#N)(CCN(C)C)c1csc2ccc(C)cc12
475292,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,313.13691,[M+H-H2O]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475293,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,313.13691,[M+H-H2O]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475294,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,313.13691,[M+H-H2O]+,60.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475295,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,313.13691,[M+H-H2O]+,30.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475296,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,313.13691,[M+H-H2O]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475297,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,331.14747,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475298,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,331.14747,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475299,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,331.14747,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475300,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,331.14747,[M+H]+,30.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475301,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1,331.14747,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)NCC2(O)CCCc3sccc32)c1
475302,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,20.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475303,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,20.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475304,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,60.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475305,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,30.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475306,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,20.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475307,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,30.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475308,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,60.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475309,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C,331.14747,[M+H]+,20.0,val,Cc1scc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1C
475310,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,331.14747,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475311,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,331.14747,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475312,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,331.14747,[M+H]+,60.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475313,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,331.14747,[M+H]+,15.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475314,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,331.14747,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475315,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,353.12942,[M+Na]+,20.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475316,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,353.12942,[M+Na]+,45.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475317,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,353.12942,[M+Na]+,60.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475318,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1,353.12942,[M+Na]+,20.0,val,CCCN(CCC)C(=O)c1ccccc1NC(=O)c1cccs1
475319,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475320,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475321,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,60.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475322,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,30.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475323,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475324,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,60.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475325,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,30.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475326,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O,331.14747,[M+H]+,20.0,val,CCCC1CC(C)(c2csc(Nc3ccc(C)cc3)n2)OC1=O
475327,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475328,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475329,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475330,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475331,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,45.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475332,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475333,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475334,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,345.1456,[M-H]-,45.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475335,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475336,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475337,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,347.16015,[M+H]+,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475338,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,347.16015,[M+H]+,15.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475339,Cc1c(C(=O)OC(C)C)c2c(ccc(OC(=O)N3CCOCC3)c2)[nH]1,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475340,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475341,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475342,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,45.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475343,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475344,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475345,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475346,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,45.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475347,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,345.1456,[M-H]-,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475348,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12,345.1456,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12
475349,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12,345.1456,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12
475350,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12,345.1456,[M-H]-,45.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12
475351,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12,345.1456,[M-H]-,60.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12
475352,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12,345.1456,[M-H]-,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)O)cc12
475353,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,311.13903,[M+H-2H2O]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475354,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,311.13903,[M+H-2H2O]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475355,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,311.13903,[M+H-2H2O]+,60.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475356,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,311.13903,[M+H-2H2O]+,30.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475357,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,311.13903,[M+H-2H2O]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475358,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475359,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475360,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,30.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475361,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,60.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475362,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,15.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475363,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475364,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,60.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475365,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1,347.16015,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)c2cc3cccc(OC)c3o2)CC1
475366,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475367,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475368,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,347.16015,[M+H]+,60.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475369,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,347.16015,[M+H]+,15.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475370,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C,347.16015,[M+H]+,20.0,val,Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C
475371,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475372,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475373,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,60.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475374,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,15.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475375,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475376,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,60.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475377,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,15.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475378,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,347.16015,[M+H]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475379,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,369.14209,[M+Na]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475380,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,369.14209,[M+Na]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475381,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,369.14209,[M+Na]+,45.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475382,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,369.14209,[M+Na]+,60.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475383,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C,369.14209,[M+Na]+,20.0,val,COc1ccccc1OCCNC(=O)Cn1cc(OC)c(=O)cc1C
475384,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,409.08974,[M-H]-,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475385,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,409.08974,[M-H]-,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475386,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,409.08974,[M-H]-,45.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475387,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,409.08974,[M-H]-,60.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475388,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,409.08974,[M-H]-,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475389,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,411.10429,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475390,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,411.10429,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475391,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,411.10429,[M+H]+,60.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475392,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,411.10429,[M+H]+,30.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475393,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,411.10429,[M+H]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475394,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,428.13084,[M+NH4]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475395,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,428.13084,[M+NH4]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475396,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,428.13084,[M+NH4]+,60.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475397,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,428.13084,[M+NH4]+,30.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475398,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C,428.13084,[M+NH4]+,20.0,val,COc1ccc(N2CCCS2(=O)=O)cc1NS(=O)(=O)c1ccc(C)cc1C
475399,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475400,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475401,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475402,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,15.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475403,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475404,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475405,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1,347.12463,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)N2CCSC(c3cccs3)CC2)c1
475406,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475407,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475408,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,45.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475409,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,60.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475410,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475411,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,60.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475412,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,45.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475413,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1,347.12463,[M+H]+,20.0,val,CC(C)(C)C1CCc2c(C(=O)N/N=C/c3cccs3)csc2C1
475414,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,309.17208,[M-H]-,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475415,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,309.17208,[M-H]-,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475416,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,309.17208,[M-H]-,60.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475417,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,309.17208,[M-H]-,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475418,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,309.17208,[M-H]-,45.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475419,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,20.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475420,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,20.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475421,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,30.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475422,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,60.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475423,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,15.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475424,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,20.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475425,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,60.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475426,Cc1c(C(=O)N2CCN(CCc3ccccc3)CC2)ccnn1,311.18664,[M+H]+,20.0,val,Cc1nnccc1C(=O)N1CCN(CCc2ccccc2)CC1
475427,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475428,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475429,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,60.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475430,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475431,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,45.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475432,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,60.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475433,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,20.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475434,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1,311.18664,[M+H]+,45.0,val,Cn1nc(C(=O)N2CCC(c3ccccn3)CC2)cc1C1CC1
475435,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475436,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475437,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,60.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475438,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,30.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475439,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475440,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,60.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475441,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,30.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475442,CCc1nn(C)c(NC(=O)C(C)c2cn(C)c3ccccc23)c1,311.18664,[M+H]+,20.0,val,CCc1cc(NC(=O)C(C)c2cn(C)c3ccccc23)n(C)n1
475443,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C,311.18664,[M+H]+,20.0,val,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C
475444,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C,311.18664,[M+H]+,20.0,val,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C
475445,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C,311.18664,[M+H]+,60.0,val,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C
475446,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C,311.18664,[M+H]+,15.0,val,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C
475447,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C,311.18664,[M+H]+,20.0,val,Cc1c(C(=O)N2CC=C(c3ccccc3)CC2)nnn1C(C)C
475448,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,20.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475449,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,20.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475450,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,60.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475451,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,30.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475452,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,20.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475453,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,60.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475454,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,30.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475455,CN(C)C(=O)c1c(N2CCC(c3ccccn3)CC2)nccc1,311.18664,[M+H]+,20.0,val,CN(C)C(=O)c1cccnc1N1CCC(c2ccccn2)CC1
475456,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1,311.18664,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1
475457,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1,311.18664,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1
475458,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1,311.18664,[M+H]+,60.0,val,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1
475459,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1,311.18664,[M+H]+,15.0,val,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1
475460,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1,311.18664,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc([C@@H]3C[C@H]3NCC3CC3)cc2)cn1
475461,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475462,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475463,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475464,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475465,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475466,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475467,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475468,COc1ccccc1-c1c2nc(C)cc(NC(C)C)n2nc1C,311.18664,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475469,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,309.17208,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475470,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,309.17208,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475471,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,309.17208,[M-H]-,60.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475472,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,309.17208,[M-H]-,30.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475473,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,309.17208,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475474,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,355.17756,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475475,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,355.17756,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475476,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,355.17756,[M+FA]-,60.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475477,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,355.17756,[M+FA]-,15.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475478,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,355.17756,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475479,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475480,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475481,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,45.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475482,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475483,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475484,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,45.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475485,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475486,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,309.17208,[M-H]-,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475487,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,345.14876,[M+Cl]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475488,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,345.14876,[M+Cl]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475489,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,345.14876,[M+Cl]-,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475490,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,345.14876,[M+Cl]-,15.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475491,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,345.14876,[M+Cl]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475492,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,355.17756,[M+FA]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475493,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,355.17756,[M+FA]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475494,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,355.17756,[M+FA]-,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475495,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,355.17756,[M+FA]-,15.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475496,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,355.17756,[M+FA]-,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475497,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475498,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475499,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,60.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475500,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475501,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,60.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475502,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,309.17208,[M-H]-,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475503,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,309.17208,[M-H]-,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475504,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,309.17208,[M-H]-,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475505,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,309.17208,[M-H]-,60.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475506,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,309.17208,[M-H]-,30.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475507,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,309.17208,[M-H]-,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475508,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475509,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475510,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475511,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,30.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475512,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475513,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,30.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475514,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475515,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,309.17208,[M-H]-,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475516,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475517,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475518,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475519,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,15.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475520,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475521,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,15.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475522,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475523,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,355.17756,[M+FA]-,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475524,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475525,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475526,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,60.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475527,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475528,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475529,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,309.17208,[M-H]-,60.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475530,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,345.14876,[M+Cl]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475531,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475532,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475533,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,355.17756,[M+FA]-,60.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475534,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,355.17756,[M+FA]-,15.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475535,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,355.17756,[M+FA]-,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475536,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,309.17208,[M-H]-,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475537,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,309.17208,[M-H]-,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475538,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,309.17208,[M-H]-,45.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475539,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,309.17208,[M-H]-,60.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475540,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,309.17208,[M-H]-,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475541,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475542,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475543,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,45.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475544,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475545,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475546,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,20.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475547,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,45.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475548,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1,311.18664,[M+H]+,60.0,val,CC(C)CC(C(=O)NCc1nc2ccccc2[nH]1)n1cccc1
475549,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475550,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475551,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,45.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475552,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,60.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475553,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475554,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,60.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475555,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475556,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1,311.18664,[M+H]+,45.0,val,Cc1cc(N2CCC(COc3ccccn3)C2)nc(C2CC2)n1
475557,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,20.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475558,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,20.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475559,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,60.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475560,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,30.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475561,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,20.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475562,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,20.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475563,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,30.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475564,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1,311.18664,[M+H]+,60.0,val,CC1(C)CC1C(=O)N1CC2CN(c3ccc(C#N)cn3)CC2C1
475565,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475566,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475567,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475568,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,30.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475569,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475570,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,30.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475571,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,60.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475572,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)N2CC(Nc3ccncn3)C2)cc1
475573,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475574,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475575,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,60.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475576,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,30.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475577,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475578,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,30.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475579,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,20.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475580,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1,311.18664,[M+H]+,60.0,val,Cc1nc(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)n[nH]1
475581,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475582,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475583,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,45.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475584,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,60.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475585,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475586,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,20.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475587,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,60.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475588,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1,311.18664,[M+H]+,45.0,val,CC(C)Cc1nc2ccc(NC(=O)C(C)n3cccc3)cc2[nH]1
475589,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,20.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475590,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,20.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475591,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,60.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475592,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,30.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475593,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,20.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475594,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,60.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475595,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,30.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475596,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1,311.18664,[M+H]+,20.0,val,O=c1ccc(C2CC2)nn1C1CCN(Cc2cccnc2)CC1
475597,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475598,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475599,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,60.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475600,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,30.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475601,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475602,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,30.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475603,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,60.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475604,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(N(C)C(=O)N2CCN(c3ccccn3)CC2)cc1
475605,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475606,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475607,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,60.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475608,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,30.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475609,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475610,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,45.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475611,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475612,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,45.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475613,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1,311.18664,[M+H]+,60.0,val,O=C(CCc1ccccc1)N1CCC(Nc2ccncn2)CC1
475614,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1
475615,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1
475616,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1,311.18664,[M+H]+,60.0,val,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1
475617,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1,311.18664,[M+H]+,30.0,val,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1
475618,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1,311.18664,[M+H]+,20.0,val,Cc1ccc(-n2cc(C(=O)NCCC3=CCCCC3)nn2)cc1
475619,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475620,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,311.18664,[M+H]+,20.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475621,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,311.18664,[M+H]+,60.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475622,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1,311.18664,[M+H]+,60.0,val,CC(C)(C)c1cc(Nc2ccc(C(N)=O)cc2)nc(C2CC2)n1
475623,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475624,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475625,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475626,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475627,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475628,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475629,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475630,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12,311.18664,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NC(C)C)cc(C)nc12
475631,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,20.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475632,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,20.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475633,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,30.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475634,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,60.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475635,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,20.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475636,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,45.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475637,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,60.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475638,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O,311.18664,[M+H]+,20.0,val,Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(N)=O
475639,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475640,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475641,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,45.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475642,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475643,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475644,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475645,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1,311.18664,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2ccnc(C3CC3)n2)CC1
475646,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475647,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475648,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,60.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475649,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,30.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475650,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475651,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,30.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475652,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,20.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475653,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C,311.18664,[M+H]+,60.0,val,Cc1ccc(NC(=O)N(C)C2CN(c3ccccn3)C2)cc1C
475654,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,20.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475655,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,20.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475656,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,30.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475657,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,60.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475658,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,15.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475659,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,20.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475660,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,60.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475661,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1,359.15362,[M+H]+,20.0,val,O=C(Cc1csc(-c2ccccn2)n1)NCC1CN2CCCC2CO1
475662,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,357.13907,[M-H]-,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475663,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,357.13907,[M-H]-,60.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475664,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,403.14455,[M+FA]-,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475665,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,403.14455,[M+FA]-,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475666,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,403.14455,[M+FA]-,60.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475667,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,403.14455,[M+FA]-,15.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475668,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,403.14455,[M+FA]-,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475669,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1,359.15362,[M+H]+,20.0,val,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1
475670,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1,359.15362,[M+H]+,20.0,val,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1
475671,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1,359.15362,[M+H]+,60.0,val,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1
475672,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1,359.15362,[M+H]+,15.0,val,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1
475673,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1,359.15362,[M+H]+,20.0,val,O=C(Cc1ccsc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1
475674,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475675,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475676,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,60.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475677,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,30.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475678,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475679,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,60.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475680,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,30.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475681,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1,359.15362,[M+H]+,20.0,val,CCSc1ccccc1C(=O)N1CCC(n2cc(NC(C)=O)cn2)C1
475682,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475683,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475684,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,60.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475685,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475686,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,45.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475687,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,60.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475688,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475689,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,373.13399,[M-H]-,45.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475690,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475691,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475692,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,60.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475693,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475694,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,45.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475695,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,60.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475696,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475697,Cc1c(C2CC2)[nH]nc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1,375.14854,[M+H]+,45.0,val,Cc1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C1CC1
475698,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475699,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475700,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,60.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475701,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,30.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475702,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475703,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,60.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475704,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,30.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475705,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,373.15174,[M-H]-,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475706,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,375.1663,[M+H]+,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475707,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,375.1663,[M+H]+,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475708,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,375.1663,[M+H]+,60.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475709,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,375.1663,[M+H]+,15.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475710,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12,375.1663,[M+H]+,20.0,val,CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)O)c2ccccc12
475711,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475712,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475713,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,60.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475714,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475715,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,45.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475716,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475717,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475718,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,45.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475719,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,60.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475720,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475721,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,45.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475722,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,60.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475723,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,325.14924,[M-H]-,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475724,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,325.14924,[M-H]-,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475725,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,325.14924,[M-H]-,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475726,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,325.14924,[M-H]-,45.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475727,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,325.14924,[M-H]-,60.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475728,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,325.14924,[M-H]-,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475729,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,20.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475730,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,20.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475731,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,45.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475732,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,60.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475733,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,20.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475734,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,45.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475735,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,60.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475736,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1,327.16379,[M+H]+,20.0,val,c1ccc(N2CC3CCN(Cc4csc(C5CC5)n4)C3C2)nc1
475737,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,327.16379,[M+H]+,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475738,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,327.16379,[M+H]+,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475739,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,327.16379,[M+H]+,60.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475740,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,327.16379,[M+H]+,15.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475741,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12,327.16379,[M+H]+,20.0,val,Cc1cc(C(C)(C)C)cc(C)c1CSc1ncnc2nc[nH]c12
475742,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475743,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475744,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,60.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475745,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,15.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475746,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475747,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,60.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475748,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,15.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475749,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1,327.16379,[M+H]+,20.0,val,Cc1ccc(NC(=S)N2CCN(c3ccccn3)CC2)c(C)c1
475750,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475751,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475752,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,45.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475753,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,60.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475754,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475755,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,45.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475756,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,20.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475757,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N,327.16379,[M+H]+,60.0,val,CCCN(CCC)c1nc(SC)nc(-c2ccccc2)c1C#N
475758,CCc1nn(C)c(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)c1,447.13799,[M+H]+,20.0,val,CCc1cc(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)n(C)n1
475759,CCc1nn(C)c(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)c1,447.13799,[M+H]+,20.0,val,CCc1cc(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)n(C)n1
475760,CCc1nn(C)c(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)c1,447.13799,[M+H]+,60.0,val,CCc1cc(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)n(C)n1
475761,CCc1nn(C)c(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)c1,447.13799,[M+H]+,30.0,val,CCc1cc(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)n(C)n1
475762,CCc1nn(C)c(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)c1,447.13799,[M+H]+,20.0,val,CCc1cc(-c2nnc(SCCSc3nnc(-c4cc(CC)nn4C)o3)o2)n(C)n1
475763,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,20.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475764,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,20.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475765,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,60.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475766,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,30.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475767,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,20.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475768,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,60.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475769,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,30.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475770,COC1CCCN(C(=O)C2CCN(c3c(Cl)cc(C(F)(F)F)cn3)CC2)C1,406.15036,[M+H]+,20.0,val,COC1CCCN(C(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)C1
475771,O=C(C(O)C1(O)CCC1)N1CCC(Cc2c(F)ccc(F)c2)CC1,340.17188,[M+H]+,20.0,val,O=C(C(O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1
475772,O=C(C(O)C1(O)CCC1)N1CCC(Cc2c(F)ccc(F)c2)CC1,340.17188,[M+H]+,20.0,val,O=C(C(O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1
475773,O=C(C(O)C1(O)CCC1)N1CCC(Cc2c(F)ccc(F)c2)CC1,340.17188,[M+H]+,60.0,val,O=C(C(O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1
475774,O=C(C(O)C1(O)CCC1)N1CCC(Cc2c(F)ccc(F)c2)CC1,340.17188,[M+H]+,30.0,val,O=C(C(O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1
475775,O=C(C(O)C1(O)CCC1)N1CCC(Cc2c(F)ccc(F)c2)CC1,340.17188,[M+H]+,20.0,val,O=C(C(O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1
475776,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475777,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475778,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475779,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,15.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475780,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475781,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,20.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475782,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,60.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475783,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1,433.15157,[M+H]+,15.0,val,Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(COc2cccc(C(F)(F)F)n2)CC1
475784,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475785,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475786,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,60.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475787,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,15.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475788,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475789,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,60.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475790,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,361.16814,[M-H]-,15.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475791,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,407.17362,[M+FA]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475792,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,407.17362,[M+FA]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475793,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,407.17362,[M+FA]-,60.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475794,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,407.17362,[M+FA]-,15.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475795,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,407.17362,[M+FA]-,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475796,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475797,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475798,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,60.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475799,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,30.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475800,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475801,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,60.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475802,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,30.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475803,CCc1c(F)cc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1,363.18269,[M+H]+,20.0,val,CCc1ccc(NC(=O)N2CCC3(C2)NC(=O)N(C(C)C)C3=O)cc1F
475804,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,429.13465,[M+Cl]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475805,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,429.13465,[M+Cl]-,15.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475806,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475807,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475808,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,60.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475809,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,15.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475810,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475811,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,60.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475812,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,15.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475813,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,439.16345,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475814,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,395.17252,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475815,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,395.17252,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475816,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,395.17252,[M+H]+,60.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475817,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,395.17252,[M+H]+,30.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475818,CC(=O)NC[C@H]1CN(c2cc(F)c(N3CCN(C(=O)CO)CC3)cc2)C(=O)O1,395.17252,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)CO)CC3)c(F)c2)C(=O)O1
475819,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475820,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475821,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475822,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475823,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475824,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,369.1957,[M-H]-,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475825,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475826,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475827,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475828,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,30.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475829,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475830,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,45.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475831,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475832,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F,371.21025,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ncnc4nc[nH]c34)CC2)c1F
475833,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,360.1565,[M-H]-,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475834,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,360.1565,[M-H]-,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475835,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,360.1565,[M-H]-,60.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475836,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,360.1565,[M-H]-,15.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475837,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,360.1565,[M-H]-,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475838,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475839,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475840,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,60.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475841,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475842,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,45.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475843,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,60.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475844,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475845,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,360.1565,[M-H]-,45.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475846,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475847,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475848,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,60.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475849,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,30.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475850,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475851,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,60.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475852,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,30.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475853,COc1cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)cc(OC)c1,362.17105,[M+H]+,20.0,val,COc1cc(OC)cc(C(C(=O)O)N2CCCC(c3nc(C)no3)C2)c1
475854,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475855,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475856,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,60.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475857,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,30.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475858,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475859,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,60.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475860,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,30.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475861,COc1c(OC)cc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1,362.17105,[M+H]+,20.0,val,COc1ccc(NC(=O)C(C)N2C(=O)NC3(CCCC3)C2=O)cc1OC
475862,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475863,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475864,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,60.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475865,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475866,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,45.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475867,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475868,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475869,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,60.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475870,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,30.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475871,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475872,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,60.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475873,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,30.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475874,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,360.1565,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475875,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475876,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475877,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,60.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475878,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,30.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475879,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)CCCn1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475880,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475881,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475882,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475883,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475884,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O,362.17105,[M+H]+,15.0,val,CC(C)[C@H](NC(=O)[C@H](C(C)C)n1c(=O)[nH]c2ccccc2c1=O)C(=O)O
475885,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1,358.16961,[M+H]+,20.0,val,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1
475886,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1,358.16961,[M+H]+,20.0,val,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1
475887,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1,358.16961,[M+H]+,60.0,val,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1
475888,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1,358.16961,[M+H]+,30.0,val,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1
475889,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1,358.16961,[M+H]+,20.0,val,O=C(NCc1nnc(-c2ccccc2)s1)N1CCC(N2CCCC2)C1
475890,O=C(NC1CCCN(c2ncnc(N3CCCC3)c2)C1)c1cscc1,358.16961,[M+H]+,20.0,val,O=C(NC1CCCN(c2cc(N3CCCC3)ncn2)C1)c1ccsc1
475891,O=C(NC1CCCN(c2ncnc(N3CCCC3)c2)C1)c1cscc1,358.16961,[M+H]+,20.0,val,O=C(NC1CCCN(c2cc(N3CCCC3)ncn2)C1)c1ccsc1
475892,O=C(NC1CCCN(c2ncnc(N3CCCC3)c2)C1)c1cscc1,358.16961,[M+H]+,60.0,val,O=C(NC1CCCN(c2cc(N3CCCC3)ncn2)C1)c1ccsc1
475893,O=C(NC1CCCN(c2ncnc(N3CCCC3)c2)C1)c1cscc1,358.16961,[M+H]+,20.0,val,O=C(NC1CCCN(c2cc(N3CCCC3)ncn2)C1)c1ccsc1
475894,O=C(NC1CCCN(c2ncnc(N3CCCC3)c2)C1)c1cscc1,358.16961,[M+H]+,45.0,val,O=C(NC1CCCN(c2cc(N3CCCC3)ncn2)C1)c1ccsc1
475895,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,388.16581,[M+Cl]-,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475896,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,398.19461,[M+FA]-,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475897,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,398.19461,[M+FA]-,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475898,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,398.19461,[M+FA]-,60.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475899,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,398.19461,[M+FA]-,15.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475900,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,398.19461,[M+FA]-,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475901,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475902,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475903,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,60.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475904,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475905,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,45.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475906,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,60.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475907,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475908,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,352.18913,[M-H]-,45.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475909,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,388.16581,[M+Cl]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475910,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,388.16581,[M+Cl]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475911,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,388.16581,[M+Cl]-,60.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475912,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,388.16581,[M+Cl]-,15.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475913,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,388.16581,[M+Cl]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475914,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,398.19461,[M+FA]-,15.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475915,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,398.19461,[M+FA]-,15.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475916,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,398.19461,[M+FA]-,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475917,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,398.19461,[M+FA]-,60.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475918,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,398.19461,[M+FA]-,15.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475919,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475920,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475921,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,60.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475922,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,30.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475923,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475924,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,60.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475925,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,30.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475926,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,352.18913,[M-H]-,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475927,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,354.20368,[M+H]+,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475928,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,354.20368,[M+H]+,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475929,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,354.20368,[M+H]+,60.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475930,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,354.20368,[M+H]+,15.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475931,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C,354.20368,[M+H]+,20.0,val,CCc1c(C(=O)Nc2cccc(-c3nnnn3C)c2)cnn1C(C)(C)C
475932,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475933,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475934,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,60.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475935,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,15.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475936,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475937,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,60.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475938,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,15.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475939,CCCc1nn(C)c(NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)c1,354.20368,[M+H]+,20.0,val,CCCc1cc(NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)n(C)n1
475940,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,354.20368,[M+H]+,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475941,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,354.20368,[M+H]+,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475942,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,354.20368,[M+H]+,60.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475943,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,354.20368,[M+H]+,15.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475944,Cc1c(C(C)NC(=O)N2CCN(c3ncc(C#N)cc3)CC2)cnn1C,354.20368,[M+H]+,20.0,val,Cc1c(C(C)NC(=O)N2CCN(c3ccc(C#N)cn3)CC2)cnn1C
475945,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475946,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475947,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,30.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475948,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,60.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475949,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475950,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,45.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475951,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,60.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475952,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21,354.20368,[M+H]+,20.0,val,Cn1ncc2c(Nc3ccccc3)nc(N3CCN(CCO)CC3)nc21
475953,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2,350.14205,[M+H]+,20.0,val,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2
475954,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2,350.14205,[M+H]+,20.0,val,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2
475955,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2,350.14205,[M+H]+,60.0,val,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2
475956,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2,350.14205,[M+H]+,30.0,val,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2
475957,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2,350.14205,[M+H]+,20.0,val,COc1cccc2c1CCN(C(=O)C1CC13CCS(=O)(=O)CC3)C2
475958,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475959,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475960,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,15.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475961,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,60.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475962,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,30.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475963,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475964,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,60.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475965,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1,350.14205,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3C[C@H]4CCS(=O)(=O)[C@H]4C3)CCC2)cc1
475966,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,394.13298,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475967,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,394.13298,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475968,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,394.13298,[M+FA]-,60.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475969,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,394.13298,[M+FA]-,15.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475970,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,394.13298,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475971,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,350.14205,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475972,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,350.14205,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475973,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,350.14205,[M+H]+,60.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475974,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,350.14205,[M+H]+,15.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475975,CCOc1ccc(CC(=O)NCC(OCCO)c2cscc2)cc1,350.14205,[M+H]+,20.0,val,CCOc1ccc(CC(=O)NCC(OCCO)c2ccsc2)cc1
475976,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,348.1275,[M-H]-,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
475977,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,348.1275,[M-H]-,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
475978,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,348.1275,[M-H]-,45.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
475979,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,348.1275,[M-H]-,60.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
475980,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,348.1275,[M-H]-,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
475981,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,20.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475982,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,20.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475983,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,60.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475984,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,30.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475985,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,20.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475986,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,30.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475987,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,60.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475988,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC,350.14205,[M+H]+,20.0,val,COc1cccc(C(=O)NCCC(CCO)c2cccs2)c1OC
475989,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC,350.14205,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC
475990,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC,350.14205,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC
475991,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC,350.14205,[M+H]+,60.0,val,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC
475992,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC,350.14205,[M+H]+,15.0,val,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC
475993,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC,350.14205,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(OC)c2ccsc2)cc1OCC
475994,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC,350.14205,[M+H]+,20.0,val,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC
475995,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC,350.14205,[M+H]+,20.0,val,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC
475996,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC,350.14205,[M+H]+,60.0,val,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC
475997,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC,350.14205,[M+H]+,30.0,val,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC
475998,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC,350.14205,[M+H]+,20.0,val,COc1cc(C(=O)NCC(C)(C)c2ccsc2)cc(OC)c1OC
475999,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1,350.14205,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1
476000,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1,350.14205,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1
476001,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1,350.14205,[M+H]+,60.0,val,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1
476002,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1,350.14205,[M+H]+,30.0,val,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1
476003,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1,350.14205,[M+H]+,20.0,val,CC(C)CS(=O)(=O)C1CCCN(C(=O)c2cc3ccccc3o2)C1
476004,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,350.14205,[M+H]+,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
476005,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,350.14205,[M+H]+,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
476006,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,350.14205,[M+H]+,45.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
476007,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,350.14205,[M+H]+,60.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
476008,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1,350.14205,[M+H]+,20.0,val,COc1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1
476009,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1,414.12488,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1
476010,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1,414.12488,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1
476011,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1,414.12488,[M+H]+,60.0,val,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1
476012,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1,414.12488,[M+H]+,30.0,val,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1
476013,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1,414.12488,[M+H]+,20.0,val,Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)CCN2C(=O)CCCC2=O)CC1
476014,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl,322.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl
476015,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl,322.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl
476016,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl,322.15683,[M+H]+,60.0,val,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl
476017,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl,322.15683,[M+H]+,30.0,val,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl
476018,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl,322.15683,[M+H]+,20.0,val,Cc1cc(OCC(=O)NCCC2=CCCCC2)cc(C)c1Cl
476019,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,20.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476020,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,20.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476021,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,60.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476022,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,20.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476023,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,60.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476024,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1,384.20057,[M+H]+,20.0,val,Cc1cc(N2CCN(C3CCN(CC(F)(F)F)C3=O)CC2)nc(C2CC2)n1
476025,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,311.18774,[M-H]-,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476026,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,311.18774,[M-H]-,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476027,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,311.18774,[M-H]-,60.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476028,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,311.18774,[M-H]-,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476029,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,311.18774,[M-H]-,60.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476030,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,347.16441,[M+Cl]-,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476031,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,311.18774,[M-H]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476032,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,311.18774,[M-H]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476033,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,311.18774,[M-H]-,60.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476034,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,311.18774,[M-H]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476035,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,311.18774,[M-H]-,45.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476036,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,357.19321,[M+FA]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476037,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,357.19321,[M+FA]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476038,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,357.19321,[M+FA]-,60.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476039,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,357.19321,[M+FA]-,15.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476040,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,357.19321,[M+FA]-,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476041,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,357.19321,[M+FA]-,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476042,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,357.19321,[M+FA]-,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476043,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,357.19321,[M+FA]-,60.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476044,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,357.19321,[M+FA]-,15.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476045,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,357.19321,[M+FA]-,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476046,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,311.18774,[M-H]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476047,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,311.18774,[M-H]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476048,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,311.18774,[M-H]-,60.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476049,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,311.18774,[M-H]-,30.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476050,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,311.18774,[M-H]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476051,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,357.19321,[M+FA]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476052,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,357.19321,[M+FA]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476053,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,357.19321,[M+FA]-,60.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476054,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,357.19321,[M+FA]-,15.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476055,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,357.19321,[M+FA]-,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476056,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,20.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476057,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,20.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476058,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,60.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476059,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,30.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476060,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,20.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476061,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,60.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476062,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,30.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476063,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1,313.20229,[M+H]+,20.0,val,CC(C)(C)n1cc(NC(=O)N2CCCc3ccccc3C2)cn1
476064,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476065,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476066,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,60.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476067,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,30.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476068,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476069,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,60.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476070,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,30.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476071,Cc1c(CNC(=O)NC2CCC(c3ccccc3)CC2)cn[nH]1,313.20229,[M+H]+,20.0,val,Cc1[nH]ncc1CNC(=O)NC1CCC(c2ccccc2)CC1
476072,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476073,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476074,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,60.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476075,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,15.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476076,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476077,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,60.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476078,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,15.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476079,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(NC(=O)N(Cc2ccccn2)CC(C)C)cc(C)n1
476080,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,20.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476081,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,20.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476082,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,30.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476083,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,60.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476084,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,15.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476085,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,20.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476086,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,60.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476087,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cn(C)nc2)c1,313.20229,[M+H]+,20.0,val,CCc1cccc(CN[C@H]2CCC(=O)N[C@@H]2c2cnn(C)c2)c1
476088,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476089,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476090,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,60.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476091,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,30.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476092,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476093,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,60.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476094,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,30.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476095,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1,313.20229,[M+H]+,20.0,val,CC(C)CC(NC(=O)C1CCn2ncnc2C1)c1ccccc1
476096,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476097,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476098,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476099,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,30.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476100,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476101,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,60.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476102,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,30.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476103,Cc1nn(-c2ccccc2NC(=O)CCC2CCNC2)c(C)c1,313.20229,[M+H]+,20.0,val,Cc1cc(C)n(-c2ccccc2NC(=O)CCC2CCNC2)n1
476104,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476105,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476106,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,60.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476107,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476108,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,45.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476109,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,60.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476110,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,20.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476111,CCc1ccc(CCNC(=O)C2CCCc3c2n(C)nn3)cc1,313.20229,[M+H]+,45.0,val,CCc1ccc(CCNC(=O)C2CCCc3nnn(C)c32)cc1
476112,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476113,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476114,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,60.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476115,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,30.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476116,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476117,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,60.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476118,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,30.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476119,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nn(C)cc1C(=O)N1C[C@@H](N)[C@H](c2ccccc2)C1
476120,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476121,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476122,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,60.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476123,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476124,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,45.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476125,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,60.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476126,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,20.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476127,Cc1cc2c(cc1)ncnc2NC1CCN(C2CCOC2)CC1,313.20229,[M+H]+,45.0,val,Cc1ccc2ncnc(NC3CCN(C4CCOC4)CC3)c2c1
476128,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476129,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476130,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476131,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476132,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476133,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476134,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476135,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476136,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476137,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476138,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476139,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476140,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476141,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476142,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476143,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476144,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476145,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476146,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476147,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476148,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2
476149,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,347.16441,[M+Cl]-,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476150,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,347.16441,[M+Cl]-,15.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476151,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,347.16441,[M+Cl]-,15.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476152,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,357.19321,[M+FA]-,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476153,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,357.19321,[M+FA]-,15.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476154,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,357.19321,[M+FA]-,15.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476155,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,357.19321,[M+FA]-,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476156,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,357.19321,[M+FA]-,60.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476157,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,311.18774,[M-H]-,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476158,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,311.18774,[M-H]-,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476159,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,311.18774,[M-H]-,75.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476160,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,311.18774,[M-H]-,60.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476161,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,311.18774,[M-H]-,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476162,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,311.18774,[M-H]-,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476163,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,311.18774,[M-H]-,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476164,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,311.18774,[M-H]-,45.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476165,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,311.18774,[M-H]-,60.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476166,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,311.18774,[M-H]-,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476167,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476168,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476169,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,60.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476170,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,30.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476171,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476172,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,30.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476173,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,20.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476174,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1,313.20229,[M+H]+,60.0,val,CC(C)c1nc2ccccc2n1C1CN(C2CCCNC2=O)C1
476175,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,20.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476176,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,20.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476177,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,60.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476178,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,30.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476179,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,20.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476180,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,30.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476181,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,20.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476182,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1,313.20229,[M+H]+,60.0,val,CCN1CCCC1CNCc1cccc(Oc2ncccn2)c1
476183,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476184,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476185,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,45.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476186,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,60.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476187,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476188,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,20.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476189,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,45.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476190,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1,313.20229,[M+H]+,60.0,val,Cn1nccc1-c1ccc(CCNC(=O)NC2CCCC2)cc1
476191,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476192,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476193,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,60.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476194,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,30.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476195,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476196,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,60.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476197,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,30.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476198,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1,313.20229,[M+H]+,20.0,val,Cc1ccc(C)c(N2CCN(c3nc(=O)c(C)c(C)[nH]3)CC2)c1
476199,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476200,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476201,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,60.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476202,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,30.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476203,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476204,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,30.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476205,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,60.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476206,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1,313.20229,[M+H]+,20.0,val,O=C(c1c[nH]c2ncccc12)N1CCN(C2CCCCC2)CC1
476207,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1
476208,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1
476209,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1,313.20229,[M+H]+,60.0,val,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1
476210,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1,313.20229,[M+H]+,30.0,val,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1
476211,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1,313.20229,[M+H]+,20.0,val,Cc1cc(N2CCC(COc3ccncc3C)CC2)nc(C)n1
476212,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476213,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476214,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,15.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476215,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,60.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476216,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,30.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476217,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476218,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,15.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476219,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,60.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476220,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1,313.20229,[M+H]+,20.0,val,Cc1cc(C)nc(N2CCC(COc3ncccc3C)CC2)n1
476221,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476222,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476223,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,60.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476224,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,15.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476225,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476226,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,60.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476227,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,15.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476228,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1,313.20229,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3ccnc(C)c3)C2)nc1
476229,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,20.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476230,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,20.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476231,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,60.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476232,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,30.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476233,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,20.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476234,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,30.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476235,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,60.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476236,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1,313.20229,[M+H]+,20.0,val,CC(C)c1noc(CN2CC3CN(c4ccccc4)CC3C2)n1
476237,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476238,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476239,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476240,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,30.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476241,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476242,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,20.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476243,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,30.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476244,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1,313.20229,[M+H]+,60.0,val,CN(C)c1cccc(C(=O)N2CCCCC2c2ccnn2C)c1
476245,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,313.20229,[M+H]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476246,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,313.20229,[M+H]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476247,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,313.20229,[M+H]+,60.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476248,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,313.20229,[M+H]+,30.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476249,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,313.20229,[M+H]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476250,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,335.18423,[M+Na]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476251,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,335.18423,[M+Na]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476252,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,335.18423,[M+Na]+,60.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476253,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,335.18423,[M+Na]+,30.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476254,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1,335.18423,[M+Na]+,20.0,val,Cc1cccc(OCC2CCCN(c3nc(C)cc(C)n3)C2)n1
476255,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476256,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476257,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476258,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476259,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476260,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,60.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476261,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,45.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476262,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2,313.20229,[M+H]+,20.0,val,CN1[C@@H]2CCC[C@H]1CC(NC(=O)c1nn(C)c3ccccc13)C2
476263,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,20.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476264,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,20.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476265,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,15.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476266,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,60.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476267,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,20.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476268,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,20.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476269,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,15.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476270,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1,313.20229,[M+H]+,60.0,val,Cc1cc(OCC2CCN(c3ncnc(C)c3C)CC2)ccn1
476271,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476272,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476273,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,60.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476274,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476275,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,45.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476276,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,60.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476277,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,327.18265,[M-H]-,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476278,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476279,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476280,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,60.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476281,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,30.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476282,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476283,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,60.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476284,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,30.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476285,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,327.18265,[M-H]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476286,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,363.15933,[M+Cl]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476287,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,363.15933,[M+Cl]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476288,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,363.15933,[M+Cl]-,60.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476289,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,363.15933,[M+Cl]-,15.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476290,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,363.15933,[M+Cl]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476291,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,373.18813,[M+FA]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476292,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,373.18813,[M+FA]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476293,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,373.18813,[M+FA]-,60.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476294,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,373.18813,[M+FA]-,15.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476295,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,373.18813,[M+FA]-,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476296,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,373.18813,[M+FA]-,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476297,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,373.18813,[M+FA]-,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476298,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,373.18813,[M+FA]-,60.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476299,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,373.18813,[M+FA]-,15.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476300,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,373.18813,[M+FA]-,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476301,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,327.18265,[M-H]-,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476302,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,327.18265,[M-H]-,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476303,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,327.18265,[M-H]-,60.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476304,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,327.18265,[M-H]-,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476305,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,327.18265,[M-H]-,60.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476306,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476307,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476308,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,60.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476309,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,30.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476310,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476311,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,60.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476312,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,30.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476313,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,327.18265,[M-H]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476314,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,363.15933,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476315,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,363.15933,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476316,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,363.15933,[M+Cl]-,60.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476317,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,363.15933,[M+Cl]-,15.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476318,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,363.15933,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476319,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,373.18813,[M+FA]-,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476320,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,373.18813,[M+FA]-,60.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476321,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,373.18813,[M+FA]-,15.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476322,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,373.18813,[M+FA]-,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476323,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476324,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476325,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,60.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476326,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476327,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,45.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476328,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,60.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476329,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476330,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,327.18265,[M-H]-,45.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476331,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,373.18813,[M+FA]-,15.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476332,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,20.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476333,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,20.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476334,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,60.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476335,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,30.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476336,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,20.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476337,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,60.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476338,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,30.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476339,COc1cc(N2CCN(C(=O)c3c(C(C)C)[nH]cc3)CC2)ncc1,329.1972,[M+H]+,20.0,val,COc1ccnc(N2CCN(C(=O)c3cc[nH]c3C(C)C)CC2)c1
476340,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476341,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476342,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,60.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476343,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,15.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476344,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476345,CC1CCN(c2nnc(-c3cc4c(cc3)OCCO4)n2C)CC1C,329.1972,[M+H]+,20.0,val,CC1CCN(c2nnc(-c3ccc4c(c3)OCCO4)n2C)CC1C
476346,CC1CCN(c2nnc(-c3cc4c(cc3)OCCO4)n2C)CC1C,329.1972,[M+H]+,20.0,val,CC1CCN(c2nnc(-c3ccc4c(c3)OCCO4)n2C)CC1C
476347,CC1CCN(c2nnc(-c3cc4c(cc3)OCCO4)n2C)CC1C,329.1972,[M+H]+,60.0,val,CC1CCN(c2nnc(-c3ccc4c(c3)OCCO4)n2C)CC1C
476348,CC1CCN(c2nnc(-c3cc4c(cc3)OCCO4)n2C)CC1C,329.1972,[M+H]+,20.0,val,CC1CCN(c2nnc(-c3ccc4c(c3)OCCO4)n2C)CC1C
476349,CC1CCN(c2nnc(-c3cc4c(cc3)OCCO4)n2C)CC1C,329.1972,[M+H]+,60.0,val,CC1CCN(c2nnc(-c3ccc4c(c3)OCCO4)n2C)CC1C
476350,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476351,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476352,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,60.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476353,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,30.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476354,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476355,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,60.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476356,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,30.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476357,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1,329.1972,[M+H]+,20.0,val,Cc1ccc(C(=O)NC(C(=O)Nc2cc(C)nn2C)C(C)C)cc1
476358,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476359,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476360,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,60.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476361,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,15.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476362,O=C(NCc1c2ccccn2nc1)NC1CCOC2(CCCC2)C1,329.1972,[M+H]+,20.0,val,O=C(NCc1cnn2ccccc12)NC1CCOC2(CCCC2)C1
476363,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476364,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476365,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,60.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476366,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,15.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476367,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476368,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,20.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476369,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,20.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476370,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,60.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476371,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,30.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476372,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,20.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476373,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,60.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476374,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,30.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476375,CCCOc1cc2c(cc1)CN(C(=O)Cc1cn(CC)nn1)CC2,329.1972,[M+H]+,20.0,val,CCCOc1ccc2c(c1)CCN(C(=O)Cc1cn(CC)nn1)C2
476376,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,20.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476377,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,20.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476378,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,60.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476379,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,15.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476380,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,20.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476381,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,60.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476382,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,15.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476383,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1,329.1972,[M+H]+,20.0,val,CC(C)COC1CCN(C(=O)c2ccccc2-n2ccnn2)CC1
476384,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476385,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476386,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,30.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476387,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,60.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476388,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,15.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476389,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476390,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,60.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476391,CCc1cc(C(=O)NC2CCN(c3nccn3C)CC2)c(O)cc1,329.1972,[M+H]+,20.0,val,CCc1ccc(O)c(C(=O)NC2CCN(c3nccn3C)CC2)c1
476392,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476393,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476394,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,60.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476395,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476396,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,45.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476397,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,60.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476398,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,20.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476399,CCN1CC[C@H]2OCCN(C(=O)Cc3cc4c(cc3)cn[nH]4)[C@H]2C1,329.1972,[M+H]+,45.0,val,CCN1CC[C@H]2OCCN(C(=O)Cc3ccc4cn[nH]c4c3)[C@H]2C1
476400,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,20.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476401,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,20.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476402,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,60.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476403,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,30.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476404,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,20.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476405,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,60.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476406,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,30.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476407,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,329.1972,[M+H]+,20.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476408,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1,351.17914,[M+Na]+,15.0,val,Cc1ccccc1Cc1noc(C2CCN(C(=O)N(C)C)CC2)n1
476409,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,311.18664,[M+H-H2O]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476410,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,311.18664,[M+H-H2O]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476411,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,311.18664,[M+H-H2O]+,60.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476412,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,311.18664,[M+H-H2O]+,30.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476413,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,311.18664,[M+H-H2O]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476414,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,329.1972,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476415,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,329.1972,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476416,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,329.1972,[M+H]+,60.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476417,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,329.1972,[M+H]+,30.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476418,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cn2CCCCc2c1,329.1972,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2cccn2)C[C@H]1O)c1cc2n(c1)CCCC2
476419,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476420,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476421,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,15.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476422,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,60.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476423,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,30.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476424,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476425,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,60.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476426,CCCNC(=O)C1CCCN(C(=O)Cc2cc3c(cc2)cn[nH]3)C1,329.1972,[M+H]+,20.0,val,CCCNC(=O)C1CCCN(C(=O)Cc2ccc3cn[nH]c3c2)C1
476427,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476428,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476429,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,60.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476430,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,15.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476431,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476432,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,60.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476433,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,15.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476434,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(-c2noc(C(C)N3CCC4(CCNC4)C3)n2)cc1
476435,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1,329.1972,[M+H]+,20.0,val,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1
476436,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1,329.1972,[M+H]+,20.0,val,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1
476437,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1,329.1972,[M+H]+,60.0,val,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1
476438,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1,329.1972,[M+H]+,15.0,val,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1
476439,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1,329.1972,[M+H]+,20.0,val,CC(C)c1noc(CN2CCCNC(=O)C2Cc2ccccc2)n1
476440,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,329.1972,[M+H]+,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476441,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,329.1972,[M+H]+,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476442,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,329.1972,[M+H]+,60.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476443,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,329.1972,[M+H]+,15.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476444,CCC(C)C(=O)N1CCCC(C(=O)NCc2cc(C#N)ncc2)C1,329.1972,[M+H]+,20.0,val,CCC(C)C(=O)N1CCCC(C(=O)NCc2ccnc(C#N)c2)C1
476445,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476446,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476447,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,60.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476448,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476449,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,45.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476450,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,60.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476451,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,20.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476452,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1,329.1972,[M+H]+,45.0,val,CCOc1ccccc1CCNC(=O)C1CCc2nc(C)nn2C1
476453,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476454,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476455,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,60.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476456,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,15.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476457,COc1cccc2c1CCC2(N)C(=O)NCc1nn(C(C)C)cc1,329.1972,[M+H]+,20.0,val,COc1cccc2c1CCC2(N)C(=O)NCc1ccn(C(C)C)n1
476458,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476459,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476460,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476461,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476462,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476463,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476464,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476465,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476466,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476467,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476468,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,45.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476469,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476470,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476471,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,45.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476472,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476473,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,327.18265,[M-H]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476474,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476475,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476476,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476477,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,15.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476478,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476479,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,15.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476480,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476481,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,363.15933,[M+Cl]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476482,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476483,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476484,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476485,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,15.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476486,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476487,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476488,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476489,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,373.18813,[M+FA]-,15.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476490,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,327.18265,[M-H]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476491,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,327.18265,[M-H]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476492,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,327.18265,[M-H]-,45.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476493,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,327.18265,[M-H]-,60.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476494,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,327.18265,[M-H]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476495,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,363.15933,[M+Cl]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476496,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,363.15933,[M+Cl]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476497,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,373.18813,[M+FA]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476498,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,373.18813,[M+FA]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476499,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,373.18813,[M+FA]-,15.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476500,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,373.18813,[M+FA]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476501,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,373.18813,[M+FA]-,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476502,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,373.18813,[M+FA]-,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476503,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,373.18813,[M+FA]-,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476504,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,373.18813,[M+FA]-,60.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476505,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,373.18813,[M+FA]-,15.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476506,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,373.18813,[M+FA]-,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476507,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,327.18265,[M-H]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476508,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,327.18265,[M-H]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476509,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,327.18265,[M-H]-,60.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476510,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,327.18265,[M-H]-,30.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476511,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,327.18265,[M-H]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476512,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,363.15933,[M+Cl]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476513,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,363.15933,[M+Cl]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476514,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,363.15933,[M+Cl]-,60.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476515,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,363.15933,[M+Cl]-,15.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476516,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,363.15933,[M+Cl]-,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476517,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476518,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476519,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,60.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476520,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,15.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476521,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476522,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,15.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476523,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476524,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,363.15933,[M+Cl]-,60.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476525,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476526,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476527,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,60.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476528,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,15.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476529,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476530,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,15.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476531,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476532,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,373.18813,[M+FA]-,60.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476533,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,20.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476534,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,20.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476535,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,45.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476536,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,60.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476537,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,20.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476538,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,60.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476539,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,45.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476540,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1,329.1972,[M+H]+,20.0,val,O=C(Cn1c(CN2CCOCC2)nc2ccccc21)N1CCCC1
476541,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476542,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476543,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,60.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476544,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,30.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476545,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476546,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,30.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476547,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476548,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,329.1972,[M+H]+,60.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476549,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,351.17914,[M+Na]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476550,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,351.17914,[M+Na]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476551,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,351.17914,[M+Na]+,60.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476552,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,351.17914,[M+Na]+,30.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476553,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C,351.17914,[M+Na]+,20.0,val,Cc1c(NC(=O)N2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C
476554,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,329.1972,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476555,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,329.1972,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476556,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,329.1972,[M+H]+,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476557,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,329.1972,[M+H]+,30.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476558,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1,329.1972,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1
476559,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476560,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476561,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476562,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476563,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476564,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476565,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476566,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCC(c2nncn2Cc2ccccc2)C1
476567,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476568,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476569,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,75.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476570,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,60.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476571,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476572,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,60.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476573,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O,329.1972,[M+H]+,75.0,val,CN1CC2(CC3CCC(C2)N3c2ccnc(C3CC3)n2)OCC1=O
476574,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,20.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476575,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,20.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476576,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,30.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476577,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,60.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476578,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,15.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476579,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,20.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476580,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,60.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476581,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1,329.1972,[M+H]+,20.0,val,CCCOc1ccc(CCC(=O)N2CCC(n3ccnn3)C2)cc1
476582,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476583,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476584,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,30.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476585,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,60.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476586,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476587,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,45.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476588,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,20.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476589,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1,329.1972,[M+H]+,60.0,val,Cc1cc(N2CCC(NC(=O)C(C)Oc3ccccc3)CC2)n[nH]1
476590,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,329.1972,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476591,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,329.1972,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476592,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,329.1972,[M+H]+,45.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476593,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,329.1972,[M+H]+,60.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476594,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1,329.1972,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)Nc1cnn(C2CCOCC2)c1
476595,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,20.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476596,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,20.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476597,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,45.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476598,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,60.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476599,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,20.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476600,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,60.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476601,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,45.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476602,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1,329.1972,[M+H]+,20.0,val,O=C(NCCCNC1CCCCC1)c1nc(=O)c2ccccc2[nH]1
476603,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1,329.1972,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1
476604,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1,329.1972,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1
476605,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1,329.1972,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1
476606,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1,329.1972,[M+H]+,15.0,val,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1
476607,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1,329.1972,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccccc3)[nH]n2)CC1
476608,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1
476609,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1
476610,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1,329.1972,[M+H]+,60.0,val,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1
476611,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1,329.1972,[M+H]+,15.0,val,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1
476612,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CN2CCN(C(=O)c3cccn3C)CC2)cn1
476613,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,329.1972,[M+H]+,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476614,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,329.1972,[M+H]+,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476615,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,329.1972,[M+H]+,60.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476616,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,329.1972,[M+H]+,30.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476617,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1,329.1972,[M+H]+,20.0,val,COc1cccc(CCC(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1
476618,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476619,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476620,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,45.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476621,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,60.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476622,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476623,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,45.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476624,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,60.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476625,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1,329.1972,[M+H]+,20.0,val,CCOc1ccc(CC(=O)N2CCC(c3nncn3C)CC2)cc1
476626,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476627,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476628,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,45.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476629,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,60.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476630,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476631,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,45.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476632,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,60.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476633,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1,329.1972,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC(c3n[nH]c(C)n3)C2)cc1
476634,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,20.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476635,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,20.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476636,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,45.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476637,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,60.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476638,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,20.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476639,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,20.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476640,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,45.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476641,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,329.1972,[M+H]+,60.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476642,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1,351.17914,[M+Na]+,45.0,val,Cc1cc(C)c(C#N)c(N2CCOC(C(=O)N3CCCCC3)C2)n1
476643,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,20.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476644,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,20.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476645,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,45.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476646,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,60.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476647,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,20.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476648,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,20.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476649,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,60.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476650,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1,329.1972,[M+H]+,45.0,val,O=C1C2CCCN2C(=O)N1CCN1CCN(c2ccccc2)CC1
476651,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476652,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476653,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476654,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476655,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476656,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476657,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476658,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1,329.1972,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)N2CCCC(c3cnn(C)c3)C2)cn1
476659,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,328.18938,[M]+,30.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476660,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,328.18938,[M]+,30.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476661,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,328.18938,[M]+,60.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476662,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,328.18938,[M]+,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476663,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,328.18938,[M]+,30.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476664,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,329.1972,[M+H]+,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476665,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,329.1972,[M+H]+,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476666,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,329.1972,[M+H]+,60.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476667,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,329.1972,[M+H]+,30.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476668,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21,329.1972,[M+H]+,20.0,val,CCn1cc(NC(=O)NCCCN2CCCC2=O)c2ccccc21
476669,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,20.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476670,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,20.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476671,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,15.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476672,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,60.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476673,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,30.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476674,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,20.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476675,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,20.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476676,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N,329.1972,[M+H]+,60.0,val,Cc1c(C2CCN(C(=O)NCCc3ccccc3)CC2)noc1N
476677,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476678,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476679,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,60.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476680,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,30.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476681,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476682,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,30.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476683,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,60.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476684,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1,329.1972,[M+H]+,20.0,val,CCc1cnc(N2CCCC(COc3cccc(OC)n3)C2)nc1
476685,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476686,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476687,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476688,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476689,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476690,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,60.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476691,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,30.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476692,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1,329.1972,[M+H]+,20.0,val,COCCC(=O)N1CCCCC1c1nncn1Cc1ccccc1
476693,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,20.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476694,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,20.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476695,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,45.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476696,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,60.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476697,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,20.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476698,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,60.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476699,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,45.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476700,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1,329.1972,[M+H]+,20.0,val,CCn1ccnc1N1CCN(C(=O)C(C)Oc2ccccc2)CC1
476701,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,321.16965,[M+H]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476702,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,321.16965,[M+H]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476703,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,321.16965,[M+H]+,60.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476704,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,321.16965,[M+H]+,15.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476705,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,321.16965,[M+H]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476706,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,343.15159,[M+Na]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476707,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,343.15159,[M+Na]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476708,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,343.15159,[M+Na]+,30.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476709,Cc1cc(OC(=O)C(C)C)c(C2(COC(=O)C(C)C)CO2)cc1,343.15159,[M+Na]+,20.0,val,Cc1ccc(C2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1
476710,CC1CCCC(O)CCC/C=C/c2c(C(=O)O1)c(O)cc(OS(=O)(=O)O)c2,399.11191,[M-H]-,20.0,val,CC1CCCC(O)CCC/C=C/c2cc(OS(=O)(=O)O)cc(O)c2C(=O)O1
476711,CC1CCCC(O)CCC/C=C/c2c(C(=O)O1)c(O)cc(OS(=O)(=O)O)c2,399.11191,[M-H]-,20.0,val,CC1CCCC(O)CCC/C=C/c2cc(OS(=O)(=O)O)cc(O)c2C(=O)O1
476712,CC1CCCC(O)CCC/C=C/c2c(C(=O)O1)c(O)cc(OS(=O)(=O)O)c2,399.11191,[M-H]-,60.0,val,CC1CCCC(O)CCC/C=C/c2cc(OS(=O)(=O)O)cc(O)c2C(=O)O1
476713,CC1CCCC(O)CCC/C=C/c2c(C(=O)O1)c(O)cc(OS(=O)(=O)O)c2,399.11191,[M-H]-,30.0,val,CC1CCCC(O)CCC/C=C/c2cc(OS(=O)(=O)O)cc(O)c2C(=O)O1
476714,CC1CCCC(O)CCC/C=C/c2c(C(=O)O1)c(O)cc(OS(=O)(=O)O)c2,399.11191,[M-H]-,20.0,val,CC1CCCC(O)CCC/C=C/c2cc(OS(=O)(=O)O)cc(O)c2C(=O)O1
476715,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476716,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476717,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,45.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476718,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,60.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476719,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476720,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,45.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476721,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,60.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476722,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1,381.11722,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CCCN(C2CCOC2)CC1
476723,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,351.17256,[M-H]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476724,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,351.17256,[M-H]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476725,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,351.17256,[M-H]-,60.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476726,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,351.17256,[M-H]-,15.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476727,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,351.17256,[M-H]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476728,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,387.14924,[M+Cl]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476729,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,387.14924,[M+Cl]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476730,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,387.14924,[M+Cl]-,60.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476731,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,387.14924,[M+Cl]-,30.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476732,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,387.14924,[M+Cl]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476733,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,397.17804,[M+FA]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476734,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,397.17804,[M+FA]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476735,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,397.17804,[M+FA]-,60.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476736,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,397.17804,[M+FA]-,15.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476737,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,397.17804,[M+FA]-,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476738,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,353.18711,[M+H]+,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476739,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,353.18711,[M+H]+,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476740,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,353.18711,[M+H]+,60.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476741,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,353.18711,[M+H]+,15.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476742,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F,353.18711,[M+H]+,20.0,val,CC(O)C(NC(=O)C1CCCC1)C(=O)NCC(O)c1ccccc1F
476743,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476744,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476745,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476746,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,30.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476747,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476748,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476749,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,30.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476750,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,346.17723,[M-H]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476751,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,382.15391,[M+Cl]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476752,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,382.15391,[M+Cl]-,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476753,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,382.15391,[M+Cl]-,15.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476754,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,382.15391,[M+Cl]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476755,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476756,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476757,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476758,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,15.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476759,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476760,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476761,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,15.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476762,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,392.18271,[M+FA]-,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476763,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,346.17723,[M-H]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476764,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,346.17723,[M-H]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476765,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,346.17723,[M-H]-,60.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476766,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,346.17723,[M-H]-,30.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476767,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,346.17723,[M-H]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476768,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,392.18271,[M+FA]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476769,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,392.18271,[M+FA]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476770,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,392.18271,[M+FA]-,60.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476771,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,392.18271,[M+FA]-,15.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476772,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,392.18271,[M+FA]-,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476773,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476774,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476775,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476776,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,30.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476777,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476778,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,60.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476779,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,30.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476780,NC(=O)C1(O)CCN(C(=O)c2cc(OC3CCCCC3)ncc2)CC1,348.19178,[M+H]+,20.0,val,NC(=O)C1(O)CCN(C(=O)c2ccnc(OC3CCCCC3)c2)CC1
476781,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,30.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476782,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,30.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476783,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,20.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476784,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,60.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476785,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,30.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476786,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,20.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476787,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,60.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476788,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1,348.19178,[M+H]+,30.0,val,COCC1(O)CCN(C(C)C(=O)N2CC(=O)Nc3ccccc32)CC1
476789,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476790,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476791,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,60.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476792,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,30.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476793,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476794,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,60.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476795,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,30.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476796,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O,348.19178,[M+H]+,20.0,val,COc1ccccc1N1CC(C(=O)NCC2CN(C)CCO2)CC1=O
476797,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476798,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476799,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,60.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476800,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,30.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476801,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476802,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,60.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476803,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,30.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476804,CCCCOc1c(OC)cc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1,348.19178,[M+H]+,20.0,val,CCCCOc1ccc(C(C)NC(=O)c2cc(=O)[nH]n2C)cc1OC
476805,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,392.18271,[M+FA]-,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476806,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,392.18271,[M+FA]-,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476807,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,392.18271,[M+FA]-,60.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476808,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,392.18271,[M+FA]-,15.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476809,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,392.18271,[M+FA]-,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476810,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476811,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476812,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,60.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476813,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476814,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476815,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,346.17723,[M-H]-,60.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476816,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,392.18271,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476817,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,392.18271,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476818,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,392.18271,[M+FA]-,60.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476819,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,392.18271,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476820,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,392.18271,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476821,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,20.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476822,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,20.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476823,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,60.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476824,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,30.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476825,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,20.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476826,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,60.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476827,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,30.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476828,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1,348.19178,[M+H]+,20.0,val,CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1
476829,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,348.19178,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476830,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,348.19178,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476831,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,348.19178,[M+H]+,60.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476832,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,348.19178,[M+H]+,15.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476833,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1,348.19178,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)NC3CCCCC3)OC2=O)cc1
476834,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,20.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476835,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,20.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476836,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,15.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476837,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,60.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476838,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,30.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476839,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,20.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476840,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,20.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476841,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC,348.19178,[M+H]+,60.0,val,CCOC(=O)N/N=C1/CCN(Cc2ccccc2)CC1C(=O)OCC
476842,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476843,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476844,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,15.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476845,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,60.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476846,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,30.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476847,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476848,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,60.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476849,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O,348.19178,[M+H]+,20.0,val,CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O
476850,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476851,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476852,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476853,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,30.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476854,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476855,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476856,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,30.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476857,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,348.19178,[M+H]+,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476858,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,370.17372,[M+Na]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476859,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,370.17372,[M+Na]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476860,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,370.17372,[M+Na]+,45.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476861,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,370.17372,[M+Na]+,60.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476862,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1,370.17372,[M+Na]+,20.0,val,CN(C)C(=O)N1CCC(CNC(=O)c2cccc3c2OCCO3)CC1
476863,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476864,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476865,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,60.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476866,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,30.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476867,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476868,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476869,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1,348.19178,[M+H]+,60.0,val,CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1
476870,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1,348.19178,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1
476871,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1,348.19178,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1
476872,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1,348.19178,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1
476873,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1,348.19178,[M+H]+,15.0,val,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1
476874,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1,348.19178,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCCC1C(=O)N1CC(Oc2cccnc2)C1
476875,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476876,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476877,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,60.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476878,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,30.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476879,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476880,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,60.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476881,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,30.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476882,CCOC(=O)N1CCC(NC(=O)c2c3CCCn3c(=O)cc2OC)CC1,364.1867,[M+H]+,20.0,val,CCOC(=O)N1CCC(NC(=O)c2c(OC)cc(=O)n3c2CCC3)CC1
476883,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21,272.20089,[M+H]+,20.0,val,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21
476884,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21,272.20089,[M+H]+,20.0,val,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21
476885,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21,272.20089,[M+H]+,60.0,val,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21
476886,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21,272.20089,[M+H]+,30.0,val,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21
476887,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21,272.20089,[M+H]+,20.0,val,CC1(CCN2CCCCC2)C(=O)CCc2ccccc21
476888,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476889,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476890,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,60.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476891,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476892,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476893,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,270.18634,[M-H]-,60.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476894,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476895,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476896,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,60.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476897,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476898,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,60.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476899,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,272.20089,[M+H]+,20.0,val,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1
476900,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476901,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476902,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,30.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476903,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,60.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476904,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,15.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476905,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476906,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,60.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476907,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1,304.19072,[M+H]+,20.0,val,O=C(C1CCCOC1)N1CCC(OCc2ccccc2)CC1
476908,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476909,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476910,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,60.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476911,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,30.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476912,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476913,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,60.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476914,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,30.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476915,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)O[C@H](C)C2)cc1
476916,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476917,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476918,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,60.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476919,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,30.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476920,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476921,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,60.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476922,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,30.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476923,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
476924,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476925,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476926,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,60.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476927,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,30.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476928,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476929,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,30.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476930,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476931,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,302.17617,[M-H]-,60.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476932,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476933,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476934,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,60.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476935,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476936,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,60.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476937,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476938,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,348.18165,[M+FA]-,15.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476939,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,348.18165,[M+FA]-,15.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476940,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,348.18165,[M+FA]-,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476941,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,348.18165,[M+FA]-,60.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476942,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,348.18165,[M+FA]-,15.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476943,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476944,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476945,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,60.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476946,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476947,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,60.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476948,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,302.17617,[M-H]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476949,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,348.18165,[M+FA]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476950,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,348.18165,[M+FA]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476951,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,348.18165,[M+FA]-,60.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476952,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,348.18165,[M+FA]-,15.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476953,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,348.18165,[M+FA]-,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
476954,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476955,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476956,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,45.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476957,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,60.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476958,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476959,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,45.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476960,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476961,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,302.17617,[M-H]-,60.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
476962,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1,304.19072,[M+H]+,20.0,val,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1
476963,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1,304.19072,[M+H]+,20.0,val,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1
476964,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1,304.19072,[M+H]+,60.0,val,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1
476965,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1,304.19072,[M+H]+,15.0,val,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1
476966,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1,304.19072,[M+H]+,20.0,val,CC(=O)OC(C)(C)C(=O)N1CCCCC(c2ccccc2)C1
476967,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476968,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476969,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,304.19072,[M+H]+,60.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476970,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,304.19072,[M+H]+,30.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476971,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCCCC(=O)Nc1ccc(C(=O)OC2CCCCC2)cc1
476972,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476973,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476974,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,60.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476975,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,30.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476976,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476977,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,30.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476978,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,60.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476979,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2(C(=O)N3CCCCC3)CCOCC2)cc1
476980,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,286.18016,[M+H-H2O]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476981,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,286.18016,[M+H-H2O]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476982,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,286.18016,[M+H-H2O]+,60.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476983,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,286.18016,[M+H-H2O]+,30.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476984,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,286.18016,[M+H-H2O]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476985,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,304.19072,[M+H]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476986,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,304.19072,[M+H]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476987,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,304.19072,[M+H]+,60.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476988,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,304.19072,[M+H]+,15.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476989,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O,304.19072,[M+H]+,20.0,val,CC(CCc1ccccc1)NC(=O)C1CCCCC1C(=O)O
476990,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,304.19072,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476991,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,304.19072,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476992,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,304.19072,[M+H]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476993,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,304.19072,[M+H]+,60.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476994,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,304.19072,[M+H]+,15.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476995,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476996,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476997,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,60.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476998,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
476999,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,20.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
477000,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1,326.17266,[M+Na]+,60.0,val,CCOC(=O)c1ccccc1NC(=O)CCC1CCCCC1
477001,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477002,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477003,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477004,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,30.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477005,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477006,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,30.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477007,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477008,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1,304.19072,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(O)CNCc2ccco2)c1
477009,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477010,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477011,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,60.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477012,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,30.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477013,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477014,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,45.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477015,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,60.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477016,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1,304.19072,[M+H]+,20.0,val,CCOC(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1
477017,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1
477018,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1
477019,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1,304.19072,[M+H]+,60.0,val,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1
477020,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1,304.19072,[M+H]+,30.0,val,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1
477021,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1,304.19072,[M+H]+,20.0,val,COc1ccc(C2CCCCN(C(=O)C3CCOC3)C2)cc1
477022,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477023,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477024,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,60.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477025,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,30.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477026,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477027,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,20.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477028,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,30.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477029,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1,304.19072,[M+H]+,60.0,val,O=C(OCCN1CCOCC1)C1(c2ccccc2)CCCC1
477030,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,20.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477031,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,20.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477032,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,60.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477033,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,30.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477034,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,20.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477035,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,30.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477036,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,20.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477037,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1,304.19072,[M+H]+,60.0,val,COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1
477038,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,286.18016,[M+H-H2O]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477039,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,286.18016,[M+H-H2O]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477040,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,286.18016,[M+H-H2O]+,60.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477041,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,286.18016,[M+H-H2O]+,30.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477042,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,286.18016,[M+H-H2O]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477043,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,304.19072,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477044,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,304.19072,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477045,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,304.19072,[M+H]+,60.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477046,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,304.19072,[M+H]+,30.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477047,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C,304.19072,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
477048,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,363.19255,[M+FA]-,15.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477049,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,363.19255,[M+FA]-,20.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477050,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,363.19255,[M+FA]-,60.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477051,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,363.19255,[M+FA]-,15.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477052,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,317.18707,[M-H]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477053,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,317.18707,[M-H]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477054,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,317.18707,[M-H]-,60.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477055,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,317.18707,[M-H]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477056,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,317.18707,[M-H]-,45.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477057,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,363.19255,[M+FA]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477058,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,363.19255,[M+FA]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477059,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,363.19255,[M+FA]-,60.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477060,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,363.19255,[M+FA]-,15.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477061,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,363.19255,[M+FA]-,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477062,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,20.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477063,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,20.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477064,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,60.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477065,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,15.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477066,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,20.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477067,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,15.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477068,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,319.20162,[M+H]+,20.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477069,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,341.18356,[M+Na]+,45.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477070,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,341.18356,[M+Na]+,45.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477071,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,341.18356,[M+Na]+,20.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477072,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,341.18356,[M+Na]+,60.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477073,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O,341.18356,[M+Na]+,45.0,val,CCOc1ccccc1CNC(=O)CN1CCCCCCC1=O
477074,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,20.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477075,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,20.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477076,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,30.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477077,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,60.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477078,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,15.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477079,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,20.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477080,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,60.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477081,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1,319.20162,[M+H]+,20.0,val,COc1ccccc1C1CCN(C(=O)NC2CCC(O)CC2)C1
477082,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477083,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477084,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477085,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,30.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477086,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477087,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477088,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,30.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477089,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)NCC2CCOCC2)cc1
477090,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477091,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477092,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,60.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477093,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,30.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477094,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477095,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,60.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477096,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,30.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477097,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1,319.20162,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)C(Cc2ccccc2)C(C)C)CCO1
477098,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477099,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477100,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,60.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477101,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,30.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477102,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477103,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,60.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477104,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,30.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477105,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O,319.20162,[M+H]+,20.0,val,Cc1cc(CCNC(=O)N2CCC3(CCOC3)C2)cc(C)c1O
477106,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,319.20162,[M+H]+,20.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477107,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,319.20162,[M+H]+,20.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477108,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,319.20162,[M+H]+,60.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477109,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,319.20162,[M+H]+,30.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477110,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1,319.20162,[M+H]+,20.0,val,CC1(CNC(=O)NCC2OCCc3ccccc32)CCOCC1
477111,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,20.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477112,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,20.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477113,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,60.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477114,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,30.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477115,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,20.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477116,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,60.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477117,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,30.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477118,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1,319.20162,[M+H]+,20.0,val,COCC(NC(=O)N1CCOCC2(CCC2)C1)c1ccccc1
477119,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1,319.20162,[M+H]+,15.0,val,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1
477120,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1,319.20162,[M+H]+,15.0,val,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1
477121,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1,319.20162,[M+H]+,20.0,val,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1
477122,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1,319.20162,[M+H]+,60.0,val,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1
477123,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1,319.20162,[M+H]+,15.0,val,CC(C)(C)C(=O)NCC(=O)N1CCOC(Cc2ccccc2)C1
477124,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477125,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477126,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,60.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477127,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,30.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477128,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477129,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,45.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477130,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,60.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477131,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,317.18707,[M-H]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477132,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477133,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477134,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,60.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477135,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,15.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477136,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477137,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,60.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477138,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,15.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477139,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,363.19255,[M+FA]-,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477140,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,317.18707,[M-H]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477141,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,317.18707,[M-H]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477142,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,317.18707,[M-H]-,60.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477143,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,317.18707,[M-H]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477144,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,317.18707,[M-H]-,60.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477145,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,363.19255,[M+FA]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477146,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,363.19255,[M+FA]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477147,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,363.19255,[M+FA]-,60.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477148,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,363.19255,[M+FA]-,15.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477149,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,363.19255,[M+FA]-,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477150,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477151,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477152,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,60.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477153,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,15.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477154,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477155,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,15.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477156,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477157,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,363.19255,[M+FA]-,60.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477158,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477159,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477160,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,60.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477161,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,30.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477162,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477163,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,30.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477164,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,60.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477165,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1,319.20162,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(CC(O)C3CC3)CC2)cc1
477166,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477167,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477168,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,60.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477169,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,15.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477170,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477171,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,15.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477172,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,20.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477173,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1,319.20162,[M+H]+,60.0,val,Cc1cnccc1OCC1CCN(C(=O)C2CCCCO2)CC1
477174,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477175,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477176,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,60.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477177,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,30.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477178,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477179,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,30.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477180,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,60.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477181,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21,319.20162,[M+H]+,20.0,val,COCCN1C(=O)CCc2cc(NC(=O)CC(C)(C)C)ccc21
477182,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1,319.20162,[M+H]+,20.0,val,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1
477183,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1,319.20162,[M+H]+,20.0,val,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1
477184,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1,319.20162,[M+H]+,60.0,val,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1
477185,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1,319.20162,[M+H]+,30.0,val,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1
477186,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1,319.20162,[M+H]+,20.0,val,CC(C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1
477187,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477188,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477189,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,45.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477190,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,60.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477191,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477192,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477193,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,45.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477194,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1,319.20162,[M+H]+,60.0,val,O=C(Nc1ccc(OCC2CCCO2)cc1)NC1CCCCC1
477195,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477196,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477197,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,319.20162,[M+H]+,60.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477198,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,319.20162,[M+H]+,15.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477199,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,319.20162,[M+H]+,20.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477200,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,341.18356,[M+Na]+,20.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477201,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,341.18356,[M+Na]+,45.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477202,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,341.18356,[M+Na]+,60.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477203,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1,341.18356,[M+Na]+,20.0,val,O=C(Nc1ccccc1OCC1CCCO1)NC1CCCCC1
477204,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2
477205,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2
477206,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2,319.20162,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2
477207,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2,319.20162,[M+H]+,30.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2
477208,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC2(CC1)CC(N)c1ccccc1O2
477209,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477210,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477211,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,60.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477212,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,30.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477213,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477214,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,60.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477215,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,30.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477216,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1,319.20162,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCN(CC(O)C2CC2)CC1
477217,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,20.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477218,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,20.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477219,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,30.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477220,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,60.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477221,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,15.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477222,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,20.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477223,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,60.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477224,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1,319.20162,[M+H]+,20.0,val,O=C(COCc1ccccc1)N1CCCN(C2CCOC2)CC1
477225,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1
477226,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1
477227,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1,319.20162,[M+H]+,60.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1
477228,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1,319.20162,[M+H]+,30.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1
477229,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1,319.20162,[M+H]+,20.0,val,CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2)CC1
477230,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,319.20162,[M+H]+,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477231,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,319.20162,[M+H]+,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477232,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,319.20162,[M+H]+,60.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477233,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,319.20162,[M+H]+,30.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477234,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1,319.20162,[M+H]+,20.0,val,CCCC(=O)N1CCC(C(=O)Nc2ccc(OCC)cc2)CC1
477235,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1,319.20162,[M+H]+,30.0,val,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1
477236,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1,319.20162,[M+H]+,30.0,val,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1
477237,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1,319.20162,[M+H]+,20.0,val,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1
477238,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1,319.20162,[M+H]+,60.0,val,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1
477239,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1,319.20162,[M+H]+,30.0,val,Cc1ccccc1CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1
477240,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,20.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477241,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,20.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477242,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,60.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477243,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,20.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477244,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,45.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477245,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,60.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477246,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,20.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477247,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1,363.18492,[M+H]+,45.0,val,COCCCn1c(SCC(N)=O)nnc1-c1ccc(C(C)(C)C)cc1
477248,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477249,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477250,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,60.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477251,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,30.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477252,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477253,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,30.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477254,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,60.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477255,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,380.14719,[M-H]-,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477256,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477257,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477258,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,60.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477259,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,15.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477260,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477261,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,20.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477262,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,15.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477263,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1,382.16174,[M+H]+,60.0,val,CCCCN(CCCC)C(=O)CSc1nc2sc(C)c(C)c2c(=O)[nH]1
477264,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,380.16495,[M-H]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477265,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,380.16495,[M-H]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477266,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,380.16495,[M-H]-,60.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477267,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,380.16495,[M-H]-,15.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477268,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,380.16495,[M-H]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477269,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,416.14163,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477270,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,416.14163,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477271,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,416.14163,[M+Cl]-,15.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477272,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,416.14163,[M+Cl]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477273,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477274,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477275,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,60.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477276,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,15.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477277,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477278,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,60.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477279,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,15.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477280,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,426.17043,[M+FA]-,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477281,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,382.1795,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477282,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,382.1795,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477283,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,382.1795,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477284,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,382.1795,[M+H]+,15.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477285,CC(C)(C)OC(=O)NCCCNC(=O)c1cc(OC2CCSC2)ncc1,382.1795,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCCCNC(=O)c1ccnc(OC2CCSC2)c1
477286,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,20.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477287,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,20.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477288,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,45.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477289,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,60.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477290,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,20.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477291,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,45.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477292,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,20.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477293,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1,378.19582,[M+H]+,60.0,val,CC(=O)N1CCN(CC#CCOC2CCN(c3nc(C)ns3)CC2)CC1
477294,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,392.17619,[M-H]-,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477295,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,392.17619,[M-H]-,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477296,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,392.17619,[M-H]-,60.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477297,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,392.17619,[M-H]-,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477298,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,392.17619,[M-H]-,45.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477299,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477300,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477301,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,60.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477302,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,30.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477303,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477304,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,60.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477305,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,30.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477306,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1,394.19074,[M+H]+,20.0,val,CCCCOc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1
477307,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477308,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477309,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,60.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477310,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,15.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477311,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477312,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,60.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477313,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,15.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477314,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,382.21476,[M+FA]-,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477315,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477316,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477317,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,60.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477318,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,30.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477319,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477320,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,60.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477321,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,30.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477322,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1,338.22383,[M+H]+,20.0,val,CCN1CCCCC1CNC(=O)NCC(CO)c1ccc(F)cc1
477323,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,411.19169,[M+Cl]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477324,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,411.19169,[M+Cl]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477325,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,411.19169,[M+Cl]-,15.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477326,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,411.19169,[M+Cl]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477327,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477328,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,60.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477329,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,15.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477330,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477331,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,60.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477332,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,15.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477333,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,421.22049,[M+FA]-,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477334,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,377.22956,[M+H]+,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477335,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,377.22956,[M+H]+,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477336,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,377.22956,[M+H]+,60.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477337,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,377.22956,[M+H]+,15.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477338,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1,377.22956,[M+H]+,20.0,val,Cc1nn(CCO)c(C)c1CN[C@@H]1CCN(c2cc(=O)n(C)c(=O)n2C)C1
477339,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,439.17691,[M-H]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477340,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,439.17691,[M-H]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477341,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,439.17691,[M-H]-,60.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477342,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,439.17691,[M-H]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477343,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,439.17691,[M-H]-,45.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477344,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,485.18239,[M+FA]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477345,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,485.18239,[M+FA]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477346,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,485.18239,[M+FA]-,60.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477347,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,485.18239,[M+FA]-,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477348,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,441.19146,[M+H]+,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477349,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,441.19146,[M+H]+,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477350,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,441.19146,[M+H]+,60.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477351,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,441.19146,[M+H]+,30.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477352,COCCN1CCN(C(=O)Nc2cnc(N3CCN(S(C)(=O)=O)CC3)cc2)CC1=O,441.19146,[M+H]+,20.0,val,COCCN1CCN(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)CC1=O
477353,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,382.19836,[M-H]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477354,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,382.19836,[M-H]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477355,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,382.19836,[M-H]-,60.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477356,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,382.19836,[M-H]-,30.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477357,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,382.19836,[M-H]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477358,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,384.21291,[M+H]+,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477359,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,384.21291,[M+H]+,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477360,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,384.21291,[M+H]+,60.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477361,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,384.21291,[M+H]+,15.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477362,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC,384.21291,[M+H]+,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC
477363,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,20.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477364,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,20.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477365,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,60.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477366,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,20.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477367,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,45.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477368,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,60.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477369,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,20.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477370,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2,307.238,[M+H]+,45.0,val,O=C(NC1CCC2(CCOCC2)CC1)[C@]12CCC[C@H]1NCC2
477371,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,20.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477372,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,20.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477373,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,60.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477374,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,30.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477375,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,20.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477376,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,60.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477377,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,30.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477378,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1,307.238,[M+H]+,20.0,val,CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
477379,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477380,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477381,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,60.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477382,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477383,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,45.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477384,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,20.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477385,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,20.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477386,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,45.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477387,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,60.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477388,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,20.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477389,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,60.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477390,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,20.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477391,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C,307.238,[M+H]+,45.0,val,CC12CCC(C(=O)NCCN3CCCCC3)(CC1=O)C2(C)C
477392,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477393,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477394,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,45.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477395,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,60.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477396,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1,307.238,[M+H]+,20.0,val,CC(C)[C@H]1COC(C2(C3=N[C@@H](C(C)C)CO3)CCCCC2)=N1
477397,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477398,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477399,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,45.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477400,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477401,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477402,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477403,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,45.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477404,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1,307.238,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OCCOCCN2CCNCC2)c1
477405,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,20.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477406,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,20.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477407,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,60.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477408,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,30.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477409,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,20.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477410,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,30.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477411,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,20.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477412,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1,307.238,[M+H]+,60.0,val,O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
477413,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477414,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477415,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,45.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477416,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,60.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477417,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477418,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,45.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477419,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477420,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1,351.22131,[M+H]+,60.0,val,CC(C)(C)C(=O)N1CCN(c2nc(CN3CCCCC3)cs2)CC1
477421,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,20.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477422,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,20.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477423,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,60.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477424,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,20.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477425,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,45.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477426,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,60.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477427,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,20.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477428,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21,309.25365,[M+H]+,45.0,val,O=C(NCCN1CCC(O)CC1)C1CCCC2CCCCC21
477429,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1,353.24458,[M+FA]-,20.0,val,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1
477430,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1,353.24458,[M+FA]-,20.0,val,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1
477431,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1,353.24458,[M+FA]-,60.0,val,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1
477432,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1,353.24458,[M+FA]-,15.0,val,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1
477433,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1,353.24458,[M+FA]-,20.0,val,O=C(NCCCCNC(=O)C1CCCCC1)C1CCCCC1
477434,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1,309.25365,[M+H]+,20.0,val,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1
477435,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1,309.25365,[M+H]+,20.0,val,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1
477436,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1,309.25365,[M+H]+,60.0,val,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1
477437,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1,309.25365,[M+H]+,20.0,val,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1
477438,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1,309.25365,[M+H]+,60.0,val,O=C(CC1CCCC1)NCC1CCN(C2CCOCC2)CC1
477439,C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,533.17232,[M+FA]-,20.0,val,C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
477440,C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,533.17232,[M+FA]-,20.0,val,C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
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477486,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,529.23626,[M+FA]-,20.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477487,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,529.23626,[M+FA]-,60.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477488,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,529.23626,[M+FA]-,15.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477489,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,529.23626,[M+FA]-,20.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477490,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,485.24533,[M+H]+,20.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477491,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,485.24533,[M+H]+,20.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477492,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,485.24533,[M+H]+,60.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477493,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,485.24533,[M+H]+,30.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477494,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O,485.24533,[M+H]+,20.0,val,NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O
477495,Fc1cc(F)c(Oc2nccc(-c3nc(-c4cnc5cnccn45)no3)c2)cc1,393.09061,[M+H]+,20.0,val,Fc1ccc(Oc2cc(-c3nc(-c4cnc5cnccn45)no3)ccn2)c(F)c1
477496,Fc1cc(F)c(Oc2nccc(-c3nc(-c4cnc5cnccn45)no3)c2)cc1,393.09061,[M+H]+,20.0,val,Fc1ccc(Oc2cc(-c3nc(-c4cnc5cnccn45)no3)ccn2)c(F)c1
477497,Fc1cc(F)c(Oc2nccc(-c3nc(-c4cnc5cnccn45)no3)c2)cc1,393.09061,[M+H]+,60.0,val,Fc1ccc(Oc2cc(-c3nc(-c4cnc5cnccn45)no3)ccn2)c(F)c1
477498,Fc1cc(F)c(Oc2nccc(-c3nc(-c4cnc5cnccn45)no3)c2)cc1,393.09061,[M+H]+,20.0,val,Fc1ccc(Oc2cc(-c3nc(-c4cnc5cnccn45)no3)ccn2)c(F)c1
477499,Fc1cc(F)c(Oc2nccc(-c3nc(-c4cnc5cnccn45)no3)c2)cc1,393.09061,[M+H]+,45.0,val,Fc1ccc(Oc2cc(-c3nc(-c4cnc5cnccn45)no3)ccn2)c(F)c1
477500,O=c1ccn(-c2cc(F)ccc2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1,463.06711,[M+FA]-,20.0,val,O=c1ccn(-c2cccc(F)c2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1
477501,O=c1ccn(-c2cc(F)ccc2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1,463.06711,[M+FA]-,60.0,val,O=c1ccn(-c2cccc(F)c2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1
477502,O=c1ccn(-c2cc(F)ccc2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1,463.06711,[M+FA]-,15.0,val,O=c1ccn(-c2cccc(F)c2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1
477503,O=c1ccn(-c2cc(F)ccc2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1,463.06711,[M+FA]-,20.0,val,O=c1ccn(-c2cccc(F)c2)nc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1
477504,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,313.06187,[M-H]-,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477505,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,313.06187,[M-H]-,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477506,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,313.06187,[M-H]-,60.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477507,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,313.06187,[M-H]-,15.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477508,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,313.06187,[M-H]-,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477509,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477510,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477511,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,60.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477512,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477513,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,75.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477514,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,60.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477515,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,20.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477516,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21,315.07642,[M+H]+,75.0,val,O=C(O)c1ccc2c3c1cccc3c(=O)n1c3ccccc3nc21
477517,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,20.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477518,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,20.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477519,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,60.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477520,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,20.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477521,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,45.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477522,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,60.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477523,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,20.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477524,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,360.02708,[M-H]-,45.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477525,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,362.04163,[M+H]+,30.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477526,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,362.04163,[M+H]+,30.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477527,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,362.04163,[M+H]+,20.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477528,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,362.04163,[M+H]+,60.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477529,O=C(Nc1nc2c(s1)c1c(cc2)scn1)c1cc2ccccc2cc1,362.04163,[M+H]+,30.0,val,O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1
477530,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2,410.01348,[M+H]+,20.0,val,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2
477531,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2,410.01348,[M+H]+,20.0,val,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2
477532,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2,410.01348,[M+H]+,20.0,val,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2
477533,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2,410.01348,[M+H]+,45.0,val,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2
477534,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2,410.01348,[M+H]+,20.0,val,Brc1cc2c(cc1/C=N/c1c(-c3ccco3)nc3ccccn13)OCO2
477535,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477536,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477537,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477538,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477539,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477540,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477541,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477542,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477543,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477544,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477545,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477546,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477547,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477548,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477549,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12
477550,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12
477551,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12
477552,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12
477553,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12,273.09101,[M+H]+,20.0,val,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12
477554,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12,273.09101,[M+H]+,60.0,val,O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12
477555,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,435.05362,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477556,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,435.05362,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477557,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,435.05362,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477558,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,435.05362,[M-H]-,30.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477559,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,435.05362,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477560,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477561,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477562,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,60.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477563,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477564,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,60.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477565,O=C(Nc1c(B(O)O)cc(Cl)cc1)c1cnc(Oc2ccc(C(F)(F)F)cc2)cc1,419.05762,[M+H-H2O]+,20.0,val,O=C(Nc1ccc(Cl)cc1B(O)O)c1ccc(Oc2ccc(C(F)(F)F)cc2)nc1
477566,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1,414.00033,[M+H]+,20.0,val,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1
477567,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1,414.00033,[M+H]+,20.0,val,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1
477568,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1,414.00033,[M+H]+,45.0,val,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1
477569,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1,414.00033,[M+H]+,60.0,val,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1
477570,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1,414.00033,[M+H]+,20.0,val,Cc1c(C#N)c(N)c(C(=O)c2ccc(Br)cc2)n1-c1ccc(Cl)cc1
477571,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1,426.03603,[M+H]+,20.0,val,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1
477572,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1,426.03603,[M+H]+,20.0,val,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1
477573,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1,426.03603,[M+H]+,45.0,val,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1
477574,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1,426.03603,[M+H]+,60.0,val,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1
477575,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1,426.03603,[M+H]+,20.0,val,Fc1ccccc1-c1noc(-c2cncnc2NCc2ccccc2Br)n1
477576,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,463.06933,[M+FA]-,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477577,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,463.06933,[M+FA]-,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477578,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,463.06933,[M+FA]-,60.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477579,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,463.06933,[M+FA]-,15.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477580,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,463.06933,[M+FA]-,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477581,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477582,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477583,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,60.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477584,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,30.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477585,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477586,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,60.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477587,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,30.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477588,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1cc(F)c(F)cc1,419.07841,[M+H]+,20.0,val,O=S(=O)(c1cccn2cnnc12)N(Cc1ccccc1F)c1ccc(F)c(F)c1
477589,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,458.01222,[M-H]-,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477590,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,458.01222,[M-H]-,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477591,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,458.01222,[M-H]-,60.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477592,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,458.01222,[M-H]-,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477593,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,458.01222,[M-H]-,45.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477594,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477595,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477596,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,60.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477597,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477598,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,45.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477599,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,60.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477600,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,20.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477601,O=S(=O)(O)c1cc2c(cc1)cc(N=Nc1cc(S(=O)(=O)O)c3cccnc3c1O)cc2,460.02677,[M+H]+,45.0,val,O=S(=O)(O)c1ccc2cc(N=Nc3cc(S(=O)(=O)O)c4cccnc4c3O)ccc2c1
477602,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477603,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477604,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,30.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477605,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477606,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477607,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477608,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,15.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477609,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477610,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477611,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477612,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,30.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477613,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,419.00294,[M-H]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477614,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477615,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477616,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,15.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477617,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,454.97962,[M+Cl]-,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477618,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477619,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477620,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477621,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477622,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477623,CS(=O)(=O)c1cc(Cl)c(C(=O)Nc2cc(-c3ccccn3)c(Cl)cc2)cc1,421.01749,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1
477624,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477625,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477626,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,60.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477627,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,30.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477628,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477629,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,60.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477630,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,30.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477631,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,362.08141,[M-H]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477632,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,398.05809,[M+Cl]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477633,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,398.05809,[M+Cl]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477634,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,398.05809,[M+Cl]-,60.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477635,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,398.05809,[M+Cl]-,15.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477636,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,398.05809,[M+Cl]-,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477637,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,364.09596,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477638,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,364.09596,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477639,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,364.09596,[M+H]+,60.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477640,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,364.09596,[M+H]+,20.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477641,O=C(Cc1ccccc1Cl)Nc1ccc(-c2nn3cnnc3cc2)cc1,364.09596,[M+H]+,60.0,val,O=C(Cc1ccccc1Cl)Nc1ccc(-c2ccc3nncn3n2)cc1
477642,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,20.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477643,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,20.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477644,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,60.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477645,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,30.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477646,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,20.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477647,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,60.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477648,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,30.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477649,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1,364.09596,[M+H]+,20.0,val,N#Cc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)c(Cl)c1
477650,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477651,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477652,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,15.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477653,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,60.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477654,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,30.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477655,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477656,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,60.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477657,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,355.08997,[M-H]-,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477658,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477659,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477660,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,60.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477661,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477662,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,45.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477663,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,60.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477664,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,20.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477665,COc1cccc(-c2cc(F)c(Nc3c(C(=O)O)cccn3)c(F)c2)c1,357.10452,[M+H]+,45.0,val,COc1cccc(-c2cc(F)c(Nc3ncccc3C(=O)O)c(F)c2)c1
477666,COc1c(OC)cc(-c2nc3cc(-c4cccs4)nn3c(C(F)(F)F)c2)cc1,406.08316,[M+H]+,20.0,val,COc1ccc(-c2cc(C(F)(F)F)n3nc(-c4cccs4)cc3n2)cc1OC
477667,COc1c(OC)cc(-c2nc3cc(-c4cccs4)nn3c(C(F)(F)F)c2)cc1,406.08316,[M+H]+,20.0,val,COc1ccc(-c2cc(C(F)(F)F)n3nc(-c4cccs4)cc3n2)cc1OC
477668,COc1c(OC)cc(-c2nc3cc(-c4cccs4)nn3c(C(F)(F)F)c2)cc1,406.08316,[M+H]+,60.0,val,COc1ccc(-c2cc(C(F)(F)F)n3nc(-c4cccs4)cc3n2)cc1OC
477669,COc1c(OC)cc(-c2nc3cc(-c4cccs4)nn3c(C(F)(F)F)c2)cc1,406.08316,[M+H]+,20.0,val,COc1ccc(-c2cc(C(F)(F)F)n3nc(-c4cccs4)cc3n2)cc1OC
477670,COc1c(OC)cc(-c2nc3cc(-c4cccs4)nn3c(C(F)(F)F)c2)cc1,406.08316,[M+H]+,60.0,val,COc1ccc(-c2cc(C(F)(F)F)n3nc(-c4cccs4)cc3n2)cc1OC
477671,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477672,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477673,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,60.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477674,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,30.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477675,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477676,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,60.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477677,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,30.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477678,CC1(C)C(=O)N(c2cc(C(F)(F)F)c(C#N)cc2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477679,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477680,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477681,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,60.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477682,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,30.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477683,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477684,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,45.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477685,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,60.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477686,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1,404.06861,[M-H]-,20.0,val,CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=S)N1c1ccc(O)cc1
477687,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,20.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477688,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,20.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477689,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,45.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477690,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,60.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477691,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,20.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477692,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,60.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477693,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,45.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477694,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1,336.09652,[M+H]+,20.0,val,Cc1cc(-c2cccnc2)c(C#N)c(SCc2cccc(F)c2)n1
477695,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1,351.07979,[M+H]+,20.0,val,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1
477696,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1,351.07979,[M+H]+,20.0,val,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1
477697,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1,351.07979,[M+H]+,60.0,val,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1
477698,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1,351.07979,[M+H]+,30.0,val,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1
477699,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1,351.07979,[M+H]+,20.0,val,Cc1cccc(OC(=O)c2sc3nc(-c4ccco4)ccc3c2N)c1
477700,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc12,331.11895,[M+H]+,20.0,val,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21
477701,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc12,331.11895,[M+H]+,20.0,val,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21
477702,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc12,331.11895,[M+H]+,60.0,val,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21
477703,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc12,331.11895,[M+H]+,30.0,val,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21
477704,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc12,331.11895,[M+H]+,20.0,val,O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21
477705,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,329.1044,[M-H]-,20.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477706,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,329.1044,[M-H]-,20.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477707,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,329.1044,[M-H]-,45.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477708,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,329.1044,[M-H]-,60.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477709,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,329.1044,[M-H]-,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477710,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,329.1044,[M-H]-,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477711,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,329.1044,[M-H]-,45.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477712,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,329.1044,[M-H]-,60.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477713,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,329.1044,[M-H]-,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477714,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,331.11895,[M+H]+,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477715,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,331.11895,[M+H]+,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477716,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,331.11895,[M+H]+,60.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477717,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,331.11895,[M+H]+,20.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477718,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1,331.11895,[M+H]+,60.0,val,Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1cccnc1
477719,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477720,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477721,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477722,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477723,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477724,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1,331.11895,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4cccc5[nH]ccc45)n3)ccc2o1
477725,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,20.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477726,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,20.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477727,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,60.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477728,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,30.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477729,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,20.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477730,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,60.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477731,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,30.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477732,Cc1c(-c2ccccc2)c2c(ncn(/N=C/c3ccccn3)c2=O)s1,347.09611,[M+H]+,20.0,val,Cc1sc2ncn(/N=C/c3ccccn3)c(=O)c2c1-c1ccccc1
477733,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477734,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477735,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,45.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477736,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,60.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477737,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477738,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,45.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477739,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477740,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,345.08156,[M-H]-,60.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477741,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,345.08156,[M-H]-,20.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477742,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1,347.09611,[M+H]+,45.0,val,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1
477743,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1,347.09611,[M+H]+,45.0,val,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1
477744,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1,347.09611,[M+H]+,45.0,val,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1
477745,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1,347.09611,[M+H]+,20.0,val,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1
477746,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1,347.09611,[M+H]+,60.0,val,c1ccc(CCc2nnc3sc(-c4cc5ccccc5o4)nn23)cc1
477747,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,20.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477748,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,20.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477749,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,60.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477750,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,30.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477751,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,20.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477752,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,30.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477753,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,60.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477754,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12,347.09611,[M+H]+,20.0,val,Cc1c(-c2nnc3n2N=C(c2ccccc2)CS3)oc2ccccc12
477755,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,45.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477756,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,45.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477757,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,45.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477758,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,20.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477759,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,60.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477760,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,60.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477761,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,20.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477762,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1,347.09611,[M+H]+,45.0,val,c1ccc(Cc2nnc3n2N=C(c2cc4ccccc4o2)CS3)cc1
477763,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1,347.09611,[M+H]+,20.0,val,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1
477764,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1,347.09611,[M+H]+,20.0,val,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1
477765,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1,347.09611,[M+H]+,60.0,val,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1
477766,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1,347.09611,[M+H]+,30.0,val,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1
477767,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1,347.09611,[M+H]+,20.0,val,Cc1nc(-c2ccccc2NC(=O)c2ccc3nccnc3c2)cs1
477768,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477769,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477770,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,45.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477771,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,60.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477772,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477773,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,60.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477774,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,20.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477775,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1,347.09611,[M+H]+,45.0,val,Cc1ccccc1-c1cc(C(=O)Nc2nncs2)c2ccccc2n1
477776,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,20.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477777,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,20.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477778,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,60.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477779,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,20.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477780,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,45.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477781,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,60.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477782,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,20.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477783,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1,353.04892,[M-H]-,45.0,val,O=C1C=CC(=C(c2ccc(O)cc2)c2ccccc2S(=O)(=O)O)C=C1
477784,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,414.02589,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477785,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,414.02589,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477786,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,414.02589,[M-H]-,60.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477787,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,414.02589,[M-H]-,15.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477788,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,414.02589,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477789,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477790,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477791,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,60.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477792,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,15.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477793,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477794,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,60.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477795,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477796,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,460.03137,[M+FA]-,15.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477797,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477798,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477799,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,30.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477800,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,60.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477801,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,15.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477802,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477803,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477804,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1,416.04044,[M+H]+,60.0,val,O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1cccc(Br)c1
477805,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,374.03562,[M-H]-,20.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477806,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,374.03562,[M-H]-,20.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477807,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,374.03562,[M-H]-,15.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477808,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,374.03562,[M-H]-,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477809,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,374.03562,[M-H]-,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477810,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,374.03562,[M-H]-,60.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477811,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,374.03562,[M-H]-,30.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477812,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,374.03562,[M-H]-,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477813,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477814,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477815,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,60.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477816,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,30.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477817,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477818,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,60.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477819,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,30.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477820,O=C(O)CCCc1nc(-c2cc(Cl)c(Cl)cc2)c(-c2ccccc2)o1,376.05017,[M+H]+,20.0,val,O=C(O)CCCc1nc(-c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)o1
477821,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,376.05017,[M+H]+,20.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477822,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,376.05017,[M+H]+,20.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477823,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,376.05017,[M+H]+,60.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477824,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,376.05017,[M+H]+,30.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477825,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1,376.05017,[M+H]+,20.0,val,O=C(CC1(O)C(=O)Nc2c(Cl)ccc(Cl)c21)c1ccc(C2CC2)cc1
477826,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,20.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477827,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,20.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477828,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,60.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477829,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,30.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477830,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,20.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477831,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,60.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477832,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,30.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477833,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1,361.11584,[M+H]+,20.0,val,O=C(NCCc1coc(-c2ccc(F)cc2)n1)C(F)(F)c1ccccc1
477834,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,471.06885,[M+Cl]-,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477835,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,471.06885,[M+Cl]-,15.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477836,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477837,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477838,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,60.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477839,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,15.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477840,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477841,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,60.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477842,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,15.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477843,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,481.09766,[M+FA]-,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477844,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477845,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477846,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,60.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477847,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,30.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477848,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477849,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,60.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477850,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,30.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477851,O=[N+]([O-])c1cn2C[C@H](OCc3cnc(-c4ccc(OC(F)(F)F)cc4)cc3)COc2n1,437.10673,[M+H]+,20.0,val,O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)(F)F)cc3)nc1)C2
477852,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477853,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477854,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,60.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477855,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477856,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,45.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477857,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,60.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477858,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477859,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,333.11571,[M-H]-,45.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477860,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477861,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477862,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,60.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477863,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477864,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,60.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477865,Cc1c(C#N)cccc1C(=O)Nc1cc(F)c(-n2ccnc2C)cc1,335.13027,[M+H]+,20.0,val,Cc1c(C#N)cccc1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1
477866,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,20.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477867,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,20.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477868,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,45.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477869,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,60.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477870,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,20.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477871,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,20.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477872,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,60.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477873,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1,335.13027,[M+H]+,45.0,val,Cn1nccc1-c1cccc(-c2noc(Cc3ccccc3F)n2)c1
477874,Cn1ccc(Cn2cnc3c(sc(-c4ccccc4)c3)c2=O)cc1=O,350.09577,[M+H]+,20.0,val,Cn1ccc(Cn2cnc3cc(-c4ccccc4)sc3c2=O)cc1=O
477875,Cn1ccc(Cn2cnc3c(sc(-c4ccccc4)c3)c2=O)cc1=O,350.09577,[M+H]+,20.0,val,Cn1ccc(Cn2cnc3cc(-c4ccccc4)sc3c2=O)cc1=O
477876,Cn1ccc(Cn2cnc3c(sc(-c4ccccc4)c3)c2=O)cc1=O,350.09577,[M+H]+,60.0,val,Cn1ccc(Cn2cnc3cc(-c4ccccc4)sc3c2=O)cc1=O
477877,Cn1ccc(Cn2cnc3c(sc(-c4ccccc4)c3)c2=O)cc1=O,350.09577,[M+H]+,20.0,val,Cn1ccc(Cn2cnc3cc(-c4ccccc4)sc3c2=O)cc1=O
477878,Cn1ccc(Cn2cnc3c(sc(-c4ccccc4)c3)c2=O)cc1=O,350.09577,[M+H]+,45.0,val,Cn1ccc(Cn2cnc3cc(-c4ccccc4)sc3c2=O)cc1=O
477879,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,348.08122,[M-H]-,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477880,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,348.08122,[M-H]-,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477881,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,348.08122,[M-H]-,60.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477882,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,348.08122,[M-H]-,30.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477883,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,348.08122,[M-H]-,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477884,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,350.09577,[M+H]+,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477885,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,350.09577,[M+H]+,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477886,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,350.09577,[M+H]+,60.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477887,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,350.09577,[M+H]+,30.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477888,O=C(Cc1noc2ccccc12)NCc1c(-c2cccs2)nccc1,350.09577,[M+H]+,20.0,val,O=C(Cc1noc2ccccc12)NCc1cccnc1-c1cccs1
477889,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477890,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477891,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,45.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477892,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,60.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477893,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477894,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,45.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477895,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,60.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477896,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,348.08122,[M-H]-,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477897,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O,350.09577,[M+H]+,30.0,val,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O
477898,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O,350.09577,[M+H]+,30.0,val,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O
477899,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O,350.09577,[M+H]+,60.0,val,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O
477900,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O,350.09577,[M+H]+,20.0,val,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O
477901,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O,350.09577,[M+H]+,30.0,val,Cn1c(SCc2cc(=O)[nH]c3ccccc23)nc2ccccc2c1=O
477902,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,20.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477903,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,20.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477904,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,60.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477905,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,30.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477906,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,20.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477907,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,60.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477908,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,30.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477909,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12,350.09577,[M+H]+,20.0,val,Cc1cc2nnc(SCc3ccc4c(c3)OCO4)n2c2ccccc12
477910,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,350.09577,[M+H]+,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477911,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,350.09577,[M+H]+,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477912,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,350.09577,[M+H]+,60.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477913,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,350.09577,[M+H]+,30.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477914,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12,350.09577,[M+H]+,20.0,val,Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3ccno3)nc12
477915,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,20.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477916,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,20.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477917,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,60.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477918,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,20.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477919,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,75.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477920,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,60.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477921,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,20.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477922,c1ccc(-c2nc3c(CCC3)c(-n3ccc4c3ccnc4)n2)nc1,314.14002,[M+H]+,75.0,val,c1ccc(-c2nc3c(c(-n4ccc5cnccc54)n2)CCC3)nc1
477923,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,312.12547,[M-H]-,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477924,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,312.12547,[M-H]-,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477925,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,312.12547,[M-H]-,45.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477926,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,312.12547,[M-H]-,60.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477927,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,312.12547,[M-H]-,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477928,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,314.14002,[M+H]+,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477929,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,314.14002,[M+H]+,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477930,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,314.14002,[M+H]+,45.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477931,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,314.14002,[M+H]+,60.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477932,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N,314.14002,[M+H]+,20.0,val,Cc1cc(NCc2ccccn2)n2c(nc3ccccc32)c1C#N
477933,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,20.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477934,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,20.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477935,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,60.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477936,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,30.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477937,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,20.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477938,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,60.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477939,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,30.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477940,Cn1c2ccccc2n2c(SCc3cc4ccccc4nc3)nnc12,346.11209,[M+H]+,20.0,val,Cn1c2ccccc2n2c(SCc3cnc4ccccc4c3)nnc12
477941,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,20.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477942,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,20.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477943,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,60.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477944,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,30.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477945,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,20.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477946,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,60.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477947,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,30.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477948,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21,322.08963,[M+H]+,20.0,val,O=C(NCc1ccsc1)C1c2ccccc2Oc2ccccc21
477949,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477950,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477951,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,45.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477952,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,60.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477953,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477954,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477955,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,45.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477956,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,437.01351,[M-H]-,60.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477957,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,472.99018,[M+Cl]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477958,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,472.99018,[M+Cl]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477959,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,472.99018,[M+Cl]-,60.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477960,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,472.99018,[M+Cl]-,15.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477961,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1,472.99018,[M+Cl]-,20.0,val,CN(Cc1ccco1)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1
477962,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477963,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477964,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477965,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,15.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477966,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477967,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477968,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477969,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477970,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477971,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,45.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477972,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477973,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477974,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477975,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,15.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477976,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477977,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477978,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,15.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477979,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,425.12915,[M-H]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477980,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,461.10583,[M+Cl]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477981,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,461.10583,[M+Cl]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477982,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,461.10583,[M+Cl]-,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477983,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,461.10583,[M+Cl]-,15.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477984,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,461.10583,[M+Cl]-,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477985,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477986,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477987,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477988,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477989,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,45.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477990,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,60.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477991,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,20.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477992,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3c2cc(F)cn3)nc1N,427.1437,[M+H]+,45.0,val,COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc1N
477993,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477994,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477995,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,60.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477996,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,30.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477997,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477998,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,60.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
477999,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,30.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478000,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,335.10373,[M-H]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478001,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,371.08041,[M+Cl]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478002,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,371.08041,[M+Cl]-,15.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478003,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,381.10921,[M+FA]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478004,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,381.10921,[M+FA]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478005,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,381.10921,[M+FA]-,60.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478006,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,381.10921,[M+FA]-,15.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478007,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,381.10921,[M+FA]-,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478008,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,335.10373,[M-H]-,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478009,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,335.10373,[M-H]-,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478010,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,335.10373,[M-H]-,30.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478011,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,335.10373,[M-H]-,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478012,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,337.11828,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478013,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,337.11828,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478014,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,337.11828,[M+H]+,60.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478015,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,337.11828,[M+H]+,20.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478016,Cn1cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc2c1=O,337.11828,[M+H]+,45.0,val,Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O
478017,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,337.11828,[M+H]+,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478018,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,337.11828,[M+H]+,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478019,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,337.11828,[M+H]+,60.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478020,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,337.11828,[M+H]+,20.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478021,Cn1c(=O)cc(C(=O)Nc2cc3c(cc2)OCCO3)c2ccccc21,337.11828,[M+H]+,45.0,val,Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)OCCO3)c2ccccc21
478022,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,335.10373,[M-H]-,20.0,val,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
478023,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,335.10373,[M-H]-,20.0,val,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
478024,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,335.10373,[M-H]-,60.0,val,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
478025,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,335.10373,[M-H]-,15.0,val,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
478026,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,335.10373,[M-H]-,20.0,val,N#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
478027,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1,337.11828,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1
478028,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1,337.11828,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1
478029,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1,337.11828,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1
478030,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1,337.11828,[M+H]+,15.0,val,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1
478031,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1,337.11828,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NCc3ccc4c(c3)OCO4)no2)cc1
478032,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478033,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478034,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,60.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478035,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,30.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478036,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478037,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,30.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478038,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478039,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21,333.11684,[M+H]+,60.0,val,Cn1nc(-c2ccccc2)c2c(=S)n(Cc3ccccc3)ncc21
478040,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478041,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478042,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478043,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,15.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478044,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478045,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478046,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,15.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478047,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,307.09758,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478048,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,309.11213,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478049,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,309.11213,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478050,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,309.11213,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478051,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,309.11213,[M+H]+,30.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478052,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1,309.11213,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
478053,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,20.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478054,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,20.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478055,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,30.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478056,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,60.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478057,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,15.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478058,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,20.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478059,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,20.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478060,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C,309.11213,[M+H]+,60.0,val,CC(=O)Oc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1C
478061,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1,309.11213,[M+H]+,20.0,val,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1
478062,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1,309.11213,[M+H]+,20.0,val,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1
478063,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1,309.11213,[M+H]+,60.0,val,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1
478064,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1,309.11213,[M+H]+,30.0,val,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1
478065,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1,309.11213,[M+H]+,20.0,val,CCc1cc2c(C)cc(=O)oc2cc1OC(=O)c1ccccc1
478066,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478067,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478068,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,60.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478069,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478070,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478071,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478072,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478073,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,60.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478074,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478075,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478076,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,60.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478077,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478078,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,452.04887,[M-H]-,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478079,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,454.06342,[M+H]+,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478080,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,454.06342,[M+H]+,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478081,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,454.06342,[M+H]+,60.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478082,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,454.06342,[M+H]+,20.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478083,Cc1c(C(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c(-c2c(F)cccc2Cl)no1,454.06342,[M+H]+,15.0,val,Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
478084,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21,337.12145,[M+H]+,20.0,val,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21
478085,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21,337.12145,[M+H]+,20.0,val,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21
478086,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21,337.12145,[M+H]+,45.0,val,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21
478087,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21,337.12145,[M+H]+,60.0,val,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21
478088,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21,337.12145,[M+H]+,20.0,val,CC(C)Cn1c(-c2cccc(Cl)c2)nc2nc3ccccc3nc21
478089,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,393.10677,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478090,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,393.10677,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478091,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,393.10677,[M-H]-,60.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478092,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,393.10677,[M-H]-,15.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478093,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,393.10677,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478094,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,429.08344,[M+Cl]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478095,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,429.08344,[M+Cl]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478096,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,429.08344,[M+Cl]-,15.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478097,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,439.11224,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478098,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,439.11224,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478099,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,439.11224,[M+FA]-,60.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478100,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,439.11224,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478101,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,439.11224,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478102,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478103,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478104,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,30.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478105,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478106,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,15.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478107,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478108,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478109,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,393.10677,[M-H]-,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478110,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478111,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478112,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478113,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,15.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478114,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478115,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478116,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,15.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478117,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,429.08344,[M+Cl]-,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478118,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,439.11224,[M+FA]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478119,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,439.11224,[M+FA]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478120,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,439.11224,[M+FA]-,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478121,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,439.11224,[M+FA]-,15.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478122,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,439.11224,[M+FA]-,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478123,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,395.12132,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478124,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,395.12132,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478125,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,395.12132,[M+H]+,60.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478126,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,395.12132,[M+H]+,30.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478127,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1,395.12132,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3cccc(C(F)(F)F)c3)OC2=O)cc1
478128,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,395.12132,[M+H]+,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478129,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,395.12132,[M+H]+,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478130,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,395.12132,[M+H]+,60.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478131,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,395.12132,[M+H]+,15.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478132,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1,395.12132,[M+H]+,20.0,val,COC(=O)N1CCc2ccc(F)cc2C1C(=O)Nc1cccc(OC(F)F)c1
478133,Fc1c2nc(N3CCCCC3c3nc4ccccc4[nH]3)oc2ccc1,337.14592,[M+H]+,20.0,val,Fc1cccc2oc(N3CCCCC3c3nc4ccccc4[nH]3)nc12
478134,Fc1c2nc(N3CCCCC3c3nc4ccccc4[nH]3)oc2ccc1,337.14592,[M+H]+,20.0,val,Fc1cccc2oc(N3CCCCC3c3nc4ccccc4[nH]3)nc12
478135,Fc1c2nc(N3CCCCC3c3nc4ccccc4[nH]3)oc2ccc1,337.14592,[M+H]+,60.0,val,Fc1cccc2oc(N3CCCCC3c3nc4ccccc4[nH]3)nc12
478136,Fc1c2nc(N3CCCCC3c3nc4ccccc4[nH]3)oc2ccc1,337.14592,[M+H]+,30.0,val,Fc1cccc2oc(N3CCCCC3c3nc4ccccc4[nH]3)nc12
478137,Fc1c2nc(N3CCCCC3c3nc4ccccc4[nH]3)oc2ccc1,337.14592,[M+H]+,20.0,val,Fc1cccc2oc(N3CCCCC3c3nc4ccccc4[nH]3)nc12
478138,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,335.13136,[M-H]-,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478139,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,335.13136,[M-H]-,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478140,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,335.13136,[M-H]-,60.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478141,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,335.13136,[M-H]-,15.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478142,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,335.13136,[M-H]-,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478143,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,336.13864,[M]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478144,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,336.13864,[M]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478145,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,336.13864,[M]+,60.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478146,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,336.13864,[M]+,30.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478147,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,336.13864,[M]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478148,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,337.14592,[M+H]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478149,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,337.14592,[M+H]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478150,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,337.14592,[M+H]+,60.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478151,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,337.14592,[M+H]+,20.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478152,N#Cc1cc(F)c(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1,337.14592,[M+H]+,45.0,val,N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1
478153,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,20.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478154,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,20.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478155,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,60.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478156,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,30.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478157,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,20.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478158,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,60.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478159,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,30.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478160,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2nnccc2)CC1,369.11799,[M+H]+,20.0,val,O=C(c1ccc(-c2ccc(F)cc2)s1)N1CCN(c2cccnn2)CC1
478161,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,20.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478162,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,20.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478163,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,60.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478164,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,20.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478165,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,45.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478166,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,60.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478167,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,20.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478168,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1nnc2CCCc2c1,369.11799,[M+H]+,45.0,val,O=C(NCCc1csc(-c2ccc(F)cc2)n1)c1cc2c(nn1)CCC2
478169,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C,329.11836,[M+H]+,20.0,val,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C
478170,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C,329.11836,[M+H]+,20.0,val,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C
478171,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C,329.11836,[M+H]+,45.0,val,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C
478172,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C,329.11836,[M+H]+,60.0,val,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C
478173,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C,329.11836,[M+H]+,20.0,val,CCOc1ccc2c(=O)c(Oc3ccc(F)cc3)c(C)oc2c1C
478174,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478175,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478176,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,60.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478177,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,30.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478178,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478179,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,60.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478180,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,30.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478181,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,350.09687,[M-H]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478182,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,396.10235,[M+FA]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478183,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,396.10235,[M+FA]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478184,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,396.10235,[M+FA]-,60.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478185,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,396.10235,[M+FA]-,15.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478186,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,396.10235,[M+FA]-,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478187,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,352.11142,[M+H]+,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478188,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,352.11142,[M+H]+,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478189,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,352.11142,[M+H]+,60.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478190,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,352.11142,[M+H]+,15.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478191,NC(=O)c1cc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)ccc1,352.11142,[M+H]+,20.0,val,NC(=O)c1cccc(NC(=O)c2c(-n3cccc3)sc3c2CCC3)c1
478192,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,350.09687,[M-H]-,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478193,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,350.09687,[M-H]-,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478194,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,350.09687,[M-H]-,60.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478195,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,350.09687,[M-H]-,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478196,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,350.09687,[M-H]-,45.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478197,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,352.11142,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478198,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,352.11142,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478199,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,352.11142,[M+H]+,60.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478200,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,352.11142,[M+H]+,15.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478201,CC(=O)Nc1ccc(C(=O)Nc2c(N)ccc(-c3cccs3)c2)cc1,352.11142,[M+H]+,20.0,val,CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cccs3)ccc2N)cc1
478202,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478203,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478204,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,60.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478205,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,15.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478206,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478207,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,60.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478208,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,15.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478209,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,350.09687,[M-H]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478210,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,386.07355,[M+Cl]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478211,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,386.07355,[M+Cl]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478212,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,386.07355,[M+Cl]-,60.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478213,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,386.07355,[M+Cl]-,15.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478214,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,386.07355,[M+Cl]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478215,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,396.10235,[M+FA]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478216,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,396.10235,[M+FA]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478217,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,396.10235,[M+FA]-,60.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478218,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,396.10235,[M+FA]-,15.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478219,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,396.10235,[M+FA]-,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478220,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,352.11142,[M+H]+,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478221,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,352.11142,[M+H]+,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478222,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,352.11142,[M+H]+,60.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478223,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,352.11142,[M+H]+,15.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478224,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1,352.11142,[M+H]+,20.0,val,Cc1ccccc1C(=O)Nc1ccccc1NC(=O)Nc1cccs1
478225,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478226,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478227,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,60.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478228,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478229,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,45.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478230,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,60.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478231,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478232,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,382.06894,[M-H]-,45.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478233,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,418.04562,[M+Cl]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478234,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,418.04562,[M+Cl]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478235,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,418.04562,[M+Cl]-,60.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478236,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,418.04562,[M+Cl]-,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478237,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478238,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478239,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,60.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478240,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478241,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,45.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478242,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,60.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478243,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,20.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478244,CC(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1,384.08349,[M+H]+,45.0,val,CC(C)S(=O)(=O)c1ccc2nccc(Nc3ccc4scnc4c3)c2c1
478245,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,382.06894,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478246,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,382.06894,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478247,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,382.06894,[M-H]-,60.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478248,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,382.06894,[M-H]-,30.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478249,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,382.06894,[M-H]-,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478250,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478251,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478252,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,60.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478253,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,30.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478254,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478255,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,60.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478256,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,30.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478257,Cc1cc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)ccc1,384.08349,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)c1
478258,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478259,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478260,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,60.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478261,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,30.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478262,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478263,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,60.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478264,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,30.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478265,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,314.14112,[M-H]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478266,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,350.1178,[M+Cl]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478267,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,350.1178,[M+Cl]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478268,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,350.1178,[M+Cl]-,60.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478269,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,350.1178,[M+Cl]-,15.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478270,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,350.1178,[M+Cl]-,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478271,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478272,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478273,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,60.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478274,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,30.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478275,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478276,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,60.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478277,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,30.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478278,C[C@H](N=C(NC#N)Nc1c2cccnc2ccc1)c1ccccc1,316.15567,[M+H]+,20.0,val,C[C@H](N=C(NC#N)Nc1cccc2ncccc12)c1ccccc1
478279,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,20.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478280,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,20.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478281,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,60.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478282,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,30.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478283,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,20.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478284,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,30.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478285,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,60.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478286,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N,316.15567,[M+H]+,20.0,val,N#Cc1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1N
478287,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1,316.15567,[M+H]+,30.0,val,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1
478288,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1,316.15567,[M+H]+,30.0,val,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1
478289,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1,316.15567,[M+H]+,20.0,val,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1
478290,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1,316.15567,[M+H]+,60.0,val,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1
478291,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1,316.15567,[M+H]+,30.0,val,N#Cc1ccnc(N2CC(n3c(C4CC4)nc4ccccc43)C2)c1
478292,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1,364.12266,[M+H]+,20.0,val,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1
478293,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1,364.12266,[M+H]+,20.0,val,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1
478294,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1,364.12266,[M+H]+,60.0,val,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1
478295,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1,364.12266,[M+H]+,30.0,val,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1
478296,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1,364.12266,[M+H]+,20.0,val,Cc1cc(-c2ccncc2)c(C#N)c(SCC(=O)n2nc(C)cc2C)n1
478297,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478298,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478299,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,60.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478300,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,15.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478301,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478302,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,60.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478303,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,15.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478304,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,435.04548,[M-H]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478305,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,481.05095,[M+FA]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478306,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,481.05095,[M+FA]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478307,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,481.05095,[M+FA]-,60.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478308,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,481.05095,[M+FA]-,15.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478309,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,481.05095,[M+FA]-,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478310,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478311,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478312,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,60.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478313,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478314,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,45.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478315,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,60.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478316,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,20.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478317,CSc1nnc(CNC(=O)COc2c(Cl)cc(Cl)cc2)n1-c1cccc(C)c1,437.06003,[M+H]+,45.0,val,CSc1nnc(CNC(=O)COc2ccc(Cl)cc2Cl)n1-c1cccc(C)c1
478318,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,20.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478319,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,20.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478320,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,60.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478321,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,20.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478322,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,45.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478323,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,60.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478324,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,20.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478325,O=C(c1nn2c(C3CC3)nnc2cc1)N1CCN(c2cc(Cl)c(F)cc2)CC1,401.12874,[M+H]+,45.0,val,O=C(c1ccc2nnc(C3CC3)n2n1)N1CCN(c2ccc(F)c(Cl)c2)CC1
478326,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478327,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478328,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,60.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478329,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478330,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,45.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478331,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,60.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478332,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478333,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,386.09131,[M-H]-,45.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478334,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,388.10586,[M+H]+,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478335,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,388.10586,[M+H]+,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478336,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,388.10586,[M+H]+,60.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478337,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,388.10586,[M+H]+,30.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478338,CCNC(=O)c1c(-c2ccc(OC)cc2)c(-c2cc(Cl)c(O)cc2O)n[nH]1,388.10586,[M+H]+,20.0,val,CCNC(=O)c1[nH]nc(-c2cc(Cl)c(O)cc2O)c1-c1ccc(OC)cc1
478339,COC(=O)N(OC)c1ccccc1COc1nn(-c2ccc(Cl)cc2)cc1,388.10586,[M+H]+,20.0,val,COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1
478340,COC(=O)N(OC)c1ccccc1COc1nn(-c2ccc(Cl)cc2)cc1,388.10586,[M+H]+,20.0,val,COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1
478341,COC(=O)N(OC)c1ccccc1COc1nn(-c2ccc(Cl)cc2)cc1,388.10586,[M+H]+,60.0,val,COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1
478342,COC(=O)N(OC)c1ccccc1COc1nn(-c2ccc(Cl)cc2)cc1,388.10586,[M+H]+,15.0,val,COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1
478343,COC(=O)N(OC)c1ccccc1COc1nn(-c2ccc(Cl)cc2)cc1,388.10586,[M+H]+,20.0,val,COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1
478344,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478345,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478346,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,60.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478347,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,30.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478348,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478349,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,60.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478350,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,30.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478351,O=C1Nc2c(ccc(Cl)n2)C2(CCN(C(=O)OCc3ccccc3)CC2)O1,386.09131,[M-H]-,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478352,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12,388.10586,[M+H]+,20.0,val,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12
478353,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12,388.10586,[M+H]+,20.0,val,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12
478354,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12,388.10586,[M+H]+,60.0,val,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12
478355,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12,388.10586,[M+H]+,15.0,val,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12
478356,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12,388.10586,[M+H]+,20.0,val,COc1cccc2cc(C(=O)N3CCCC(Oc4ncc(Cl)cn4)C3)oc12
478357,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,388.10586,[M+H]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478358,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,388.10586,[M+H]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478359,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,388.10586,[M+H]+,60.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478360,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,388.10586,[M+H]+,15.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478361,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,388.10586,[M+H]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478362,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,405.13241,[M+NH4]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478363,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,405.13241,[M+NH4]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478364,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,405.13241,[M+NH4]+,60.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478365,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,405.13241,[M+NH4]+,15.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478366,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1,405.13241,[M+NH4]+,20.0,val,O=C1Nc2nc(Cl)ccc2C2(CCN(C(=O)OCc3ccccc3)CC2)O1
478367,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,418.06338,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478368,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,418.06338,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478369,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,418.06338,[M-H]-,60.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478370,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,418.06338,[M-H]-,30.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478371,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,418.06338,[M-H]-,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478372,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,418.06338,[M-H]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478373,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,418.06338,[M-H]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478374,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,418.06338,[M-H]-,60.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478375,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,418.06338,[M-H]-,15.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478376,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,418.06338,[M-H]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478377,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,454.04006,[M+Cl]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478378,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,454.04006,[M+Cl]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478379,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,454.04006,[M+Cl]-,60.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478380,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,454.04006,[M+Cl]-,15.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478381,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,454.04006,[M+Cl]-,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478382,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,420.07793,[M+H]+,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478383,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,420.07793,[M+H]+,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478384,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,420.07793,[M+H]+,60.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478385,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,420.07793,[M+H]+,15.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478386,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cc(Cl)ccc3)n2C)cc1,420.07793,[M+H]+,20.0,val,COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3cccc(Cl)c3)n2C)cc1
478387,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,420.07793,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478388,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,420.07793,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478389,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,420.07793,[M+H]+,60.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478390,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,420.07793,[M+H]+,30.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478391,Cc1c(NS(=O)(=O)c2cc3c(cc2)onc3C(=O)N2CCCC2)cc(Cl)cc1,420.07793,[M+H]+,20.0,val,Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc2onc(C(=O)N3CCCC3)c2c1
478392,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478393,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478394,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,60.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478395,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,15.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478396,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478397,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,15.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478398,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478399,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,359.12127,[M-H]-,60.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478400,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,395.09795,[M+Cl]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478401,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,395.09795,[M+Cl]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478402,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,395.09795,[M+Cl]-,60.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478403,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,395.09795,[M+Cl]-,15.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478404,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,395.09795,[M+Cl]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478405,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478406,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478407,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,60.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478408,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,15.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478409,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478410,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,20.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478411,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,15.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478412,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1,405.12675,[M+FA]-,60.0,val,COc1ccc(N2CC(C(=O)NCc3cc(F)cc(F)c3)CC2=O)cc1
478413,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478414,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478415,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,60.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478416,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,30.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478417,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478418,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,60.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478419,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,30.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478420,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478421,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478422,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478423,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,60.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478424,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,30.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478425,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478426,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,60.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478427,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,30.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478428,NC(=O)c1cn(-c2cnc(NCC3(c4c(F)cccn4)CC(F)C3)nc2)cc1,385.15829,[M+H]+,20.0,val,NC(=O)c1ccn(-c2cnc(NCC3(c4ncccc4F)CC(F)C3)nc2)c1
478429,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,20.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478430,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,20.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478431,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,60.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478432,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,20.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478433,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,60.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478434,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1,385.15829,[M+H]+,20.0,val,Fc1cccc(Nc2nc(Nc3ccccc3F)nc(N3CCOCC3)n2)c1
478435,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1,388.11257,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1
478436,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1,388.11257,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1
478437,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1,388.11257,[M+H]+,60.0,val,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1
478438,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1,388.11257,[M+H]+,30.0,val,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1
478439,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1,388.11257,[M+H]+,20.0,val,Cc1cccc(CS(=O)(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c1
478440,O=C(C1CCCC1)N(Cc1cnccc1)c1nc2c(cc(F)cc2)s1,356.12274,[M+H]+,20.0,val,O=C(C1CCCC1)N(Cc1cccnc1)c1nc2ccc(F)cc2s1
478441,O=C(C1CCCC1)N(Cc1cnccc1)c1nc2c(cc(F)cc2)s1,356.12274,[M+H]+,20.0,val,O=C(C1CCCC1)N(Cc1cccnc1)c1nc2ccc(F)cc2s1
478442,O=C(C1CCCC1)N(Cc1cnccc1)c1nc2c(cc(F)cc2)s1,356.12274,[M+H]+,60.0,val,O=C(C1CCCC1)N(Cc1cccnc1)c1nc2ccc(F)cc2s1
478443,O=C(C1CCCC1)N(Cc1cnccc1)c1nc2c(cc(F)cc2)s1,356.12274,[M+H]+,20.0,val,O=C(C1CCCC1)N(Cc1cccnc1)c1nc2ccc(F)cc2s1
478444,O=C(C1CCCC1)N(Cc1cnccc1)c1nc2c(cc(F)cc2)s1,356.12274,[M+H]+,45.0,val,O=C(C1CCCC1)N(Cc1cccnc1)c1nc2ccc(F)cc2s1
478445,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,354.10818,[M-H]-,45.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478446,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,354.10818,[M-H]-,45.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478447,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,354.10818,[M-H]-,45.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478448,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,354.10818,[M-H]-,20.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478449,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,354.10818,[M-H]-,60.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478450,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,20.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478451,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,20.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478452,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,45.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478453,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,60.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478454,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,20.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478455,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,45.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478456,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,20.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478457,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,356.12274,[M+H]+,60.0,val,CCN1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1
478458,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478459,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478460,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,321.10671,[M-H]-,60.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478461,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478462,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,321.10671,[M-H]-,45.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478463,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478464,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478465,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,60.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478466,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478467,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,45.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478468,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,60.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478469,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478470,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1,323.12126,[M+H]+,45.0,val,Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3)n2)c(C)c1
478471,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478472,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478473,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,45.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478474,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478475,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478476,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478477,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,45.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478478,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,321.10671,[M-H]-,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478479,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478480,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478481,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,45.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478482,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,60.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478483,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478484,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478485,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,45.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478486,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,321.10671,[M-H]-,60.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478487,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478488,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478489,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,30.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478490,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,60.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478491,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,15.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478492,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478493,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,60.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478494,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1,323.12126,[M+H]+,20.0,val,CCC(C(=O)Nc1nc(-c2ccccc2)cs1)c1ccccc1
478495,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,20.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478496,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,20.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478497,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,60.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478498,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,30.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478499,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,20.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478500,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,20.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478501,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,60.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478502,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2,323.12126,[M+H]+,30.0,val,S=c1nc(-c2ccccc2)n(Cc2ccco2)c2c1CCCC2
478503,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,20.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478504,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,20.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478505,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,60.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478506,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,30.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478507,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,20.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478508,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,60.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478509,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,30.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478510,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1,323.12126,[M+H]+,20.0,val,Cc1cs/c(=N\C(=O)c2ccccc2)n1CCc1ccccc1
478511,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,20.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478512,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,20.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478513,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,60.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478514,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,30.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478515,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,20.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478516,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,60.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478517,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,20.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478518,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21,323.12126,[M+H]+,30.0,val,Cn1cc(SCC(=O)N2CCc3ccccc32)c2ccccc21
478519,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478520,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478521,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478522,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,30.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478523,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478524,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,60.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478525,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,30.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478526,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1,323.12126,[M+H]+,20.0,val,Cc1cc(C)c(/C=N/NC(=O)c2csc3ccccc23)c(C)c1
478527,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,20.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478528,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,20.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478529,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,45.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478530,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,60.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478531,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,20.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478532,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,60.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478533,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,45.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478534,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2,323.12126,[M+H]+,20.0,val,Cc1nc(SCC(=O)c2ccccc2)c(C#N)c2c1CCCC2
478535,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,20.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478536,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,20.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478537,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,45.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478538,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,60.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478539,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,20.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478540,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,60.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478541,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,45.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478542,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1,323.12126,[M+H]+,20.0,val,COc1ccc(-c2ccc(SCc3ccccc3C)nn2)cc1
478543,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,20.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478544,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,20.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478545,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,60.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478546,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,30.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478547,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,20.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478548,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,60.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478549,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,30.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478550,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1,323.12126,[M+H]+,20.0,val,CC(C/C=N/NC(=O)c1csc2ccccc12)c1ccccc1
478551,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478552,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478553,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,60.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478554,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,30.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478555,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478556,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,60.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478557,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,30.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478558,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12,323.12126,[M+H]+,20.0,val,Cc1cccc(C)c1NC(=O)CSc1cccc2cccnc12
478559,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1,323.12126,[M+H]+,20.0,val,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1
478560,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1,323.12126,[M+H]+,20.0,val,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1
478561,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1,323.12126,[M+H]+,45.0,val,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1
478562,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1,323.12126,[M+H]+,60.0,val,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1
478563,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1,323.12126,[M+H]+,20.0,val,Cc1nc(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2)cs1
478564,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478565,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478566,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,60.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478567,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478568,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,45.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478569,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,60.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478570,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478571,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,381.10269,[M-H]-,45.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478572,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,381.10269,[M-H]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478573,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,381.10269,[M-H]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478574,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,381.10269,[M-H]-,60.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478575,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,381.10269,[M-H]-,30.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478576,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,381.10269,[M-H]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478577,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,417.07936,[M+Cl]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478578,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,427.10816,[M+FA]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478579,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,427.10816,[M+FA]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478580,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,427.10816,[M+FA]-,60.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478581,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,427.10816,[M+FA]-,15.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478582,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,427.10816,[M+FA]-,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478583,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,383.11724,[M+H]+,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478584,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,383.11724,[M+H]+,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478585,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,383.11724,[M+H]+,60.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478586,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,383.11724,[M+H]+,15.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478587,NC(=O)C1CCN(S(=O)(=O)c2cn(-c3ccccc3)nc2)c2ccccc21,383.11724,[M+H]+,20.0,val,NC(=O)C1CCN(S(=O)(=O)c2cnn(-c3ccccc3)c2)c2ccccc21
478588,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,383.11724,[M+H]+,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478589,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,383.11724,[M+H]+,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478590,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,383.11724,[M+H]+,60.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478591,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,383.11724,[M+H]+,20.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478592,O=C1CCCc2c(ccc(NS(=O)(=O)c3cn(-c4ccccc4)nc3)c2)N1,383.11724,[M+H]+,45.0,val,O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1
478593,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,381.10269,[M-H]-,20.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478594,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,381.10269,[M-H]-,20.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478595,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,381.10269,[M-H]-,60.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478596,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,381.10269,[M-H]-,20.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478597,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,381.10269,[M-H]-,45.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478598,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,383.11724,[M+H]+,45.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478599,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,383.11724,[M+H]+,45.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478600,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,383.11724,[M+H]+,60.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478601,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,383.11724,[M+H]+,20.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478602,C[C@@H](c1cc2c(cc1)[nH]c(=O)s2)c1nn(-c2ncc(OCCO)cc2)cc1,383.11724,[M+H]+,45.0,val,C[C@@H](c1ccc2[nH]c(=O)sc2c1)c1ccn(-c2ccc(OCCO)cn2)n1
478603,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478604,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478605,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,60.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478606,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478607,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,45.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478608,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,60.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478609,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478610,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,381.10269,[M-H]-,45.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478611,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2,381.10269,[M-H]-,20.0,val,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2
478612,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2,381.10269,[M-H]-,20.0,val,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2
478613,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2,381.10269,[M-H]-,60.0,val,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2
478614,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2,381.10269,[M-H]-,20.0,val,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2
478615,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2,381.10269,[M-H]-,45.0,val,CSc1ccccc1C(=O)Nc1nn(C)c2c1C(c1ccco1)CC(=O)N2
478616,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,383.11724,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478617,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,383.11724,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478618,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,383.11724,[M+H]+,60.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478619,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,383.11724,[M+H]+,30.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478620,CCOCc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)ccc2)s1,383.11724,[M+H]+,20.0,val,CCOCc1nnc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)s1
478621,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,20.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478622,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,20.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478623,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,60.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478624,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,30.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478625,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,20.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478626,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,30.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478627,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,60.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478628,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1,383.11724,[M+H]+,20.0,val,COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)c3scnc3C)C2)n1
478629,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,367.14008,[M+H]+,20.0,val,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1
478630,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,367.14008,[M+H]+,20.0,val,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1
478631,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,367.14008,[M+H]+,60.0,val,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1
478632,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,367.14008,[M+H]+,20.0,val,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1
478633,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,367.14008,[M+H]+,45.0,val,CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1
478634,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,20.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478635,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,20.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478636,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,60.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478637,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,20.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478638,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,45.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478639,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,60.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478640,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,20.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478641,COc1cc(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c(OC)cc1,367.14008,[M+H]+,45.0,val,COc1ccc(OC)c(N2CC(c3nc(-c4ccccn4)no3)CC2=O)c1
478642,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,365.12553,[M-H]-,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478643,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,365.12553,[M-H]-,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478644,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,365.12553,[M-H]-,60.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478645,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,365.12553,[M-H]-,30.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478646,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,365.12553,[M-H]-,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478647,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,367.14008,[M+H]+,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478648,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,367.14008,[M+H]+,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478649,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,367.14008,[M+H]+,60.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478650,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,367.14008,[M+H]+,15.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478651,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O,367.14008,[M+H]+,20.0,val,C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)n1nnc2ccccc2c1=O
478652,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478653,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478654,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,30.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478655,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,60.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478656,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478657,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,45.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478658,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,60.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478659,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,409.10883,[M-H]-,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478660,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,445.08551,[M+Cl]-,15.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478661,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,445.08551,[M+Cl]-,15.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478662,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,445.08551,[M+Cl]-,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478663,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,445.08551,[M+Cl]-,60.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478664,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,445.08551,[M+Cl]-,15.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478665,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478666,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478667,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,60.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478668,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,15.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478669,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478670,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478671,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478672,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,60.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478673,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,15.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478674,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1,411.12338,[M+H]+,20.0,val,NC(=O)CCNC(=O)c1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1
478675,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,20.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478676,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,20.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478677,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,45.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478678,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,60.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478679,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,20.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478680,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,60.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478681,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,45.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478682,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO,419.04234,[M+H]+,20.0,val,COc1ccccc1N=c1scc(-c2ccc(Br)cc2)n1CCCO
478683,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,447.05611,[M+FA]-,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478684,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,447.05611,[M+FA]-,60.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478685,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,447.05611,[M+FA]-,15.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478686,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,447.05611,[M+FA]-,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478687,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478688,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478689,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,60.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478690,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478691,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,45.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478692,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,60.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478693,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,20.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478694,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1,403.06518,[M+H]+,45.0,val,COc1ccc(OCC(O)Cn2cnc(-c3ccc(Br)cc3)c2)cc1
478695,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1,443.08256,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1
478696,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1,443.08256,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1
478697,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1,443.08256,[M+H]+,60.0,val,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1
478698,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1,443.08256,[M+H]+,15.0,val,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1
478699,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1,443.08256,[M+H]+,20.0,val,Cn1cc(-c2cnc(OC3CCN(C(=O)c4cncc(Br)c4)CC3)nc2)cn1
478700,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1,443.08256,[M+H]+,20.0,val,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1
478701,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1,443.08256,[M+H]+,20.0,val,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1
478702,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1,443.08256,[M+H]+,60.0,val,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1
478703,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1,443.08256,[M+H]+,30.0,val,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1
478704,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1,443.08256,[M+H]+,20.0,val,COc1ccccc1N1CCN(C(=O)c2nnn(-c3ccc(Br)cc3)n2)CC1
478705,O=C(Nc1ccc(Cl)cc1)N1CCN(c2c3cc[nH]c3ccc2)CC1,355.13201,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc3[nH]ccc23)CC1
478706,O=C(Nc1ccc(Cl)cc1)N1CCN(c2c3cc[nH]c3ccc2)CC1,355.13201,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc3[nH]ccc23)CC1
478707,O=C(Nc1ccc(Cl)cc1)N1CCN(c2c3cc[nH]c3ccc2)CC1,355.13201,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc3[nH]ccc23)CC1
478708,O=C(Nc1ccc(Cl)cc1)N1CCN(c2c3cc[nH]c3ccc2)CC1,355.13201,[M+H]+,15.0,val,O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc3[nH]ccc23)CC1
478709,O=C(Nc1ccc(Cl)cc1)N1CCN(c2c3cc[nH]c3ccc2)CC1,355.13201,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc3[nH]ccc23)CC1
478710,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478711,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478712,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,60.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478713,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478714,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,60.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478715,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,385.10729,[M-H]-,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478716,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,387.12184,[M+H]+,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478717,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,387.12184,[M+H]+,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478718,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,387.12184,[M+H]+,60.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478719,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,387.12184,[M+H]+,30.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478720,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21,387.12184,[M+H]+,20.0,val,Cn1cc(C(=O)NC2CCCC2)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c(=O)c21
478721,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,409.12976,[M-H]-,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478722,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,409.12976,[M-H]-,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478723,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,409.12976,[M-H]-,60.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478724,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,409.12976,[M-H]-,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478725,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,409.12976,[M-H]-,45.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478726,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478727,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478728,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,60.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478729,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,30.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478730,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478731,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,60.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478732,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,30.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478733,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478734,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478735,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478736,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,60.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478737,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,30.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478738,Cc1nn2c(N3CCN(Cc4nc5c(cc(Cl)cc5)c(=O)[nH]4)CC3)cncc2n1,411.14431,[M+H]+,20.0,val,Cc1nc2cncc(N3CCN(Cc4nc5ccc(Cl)cc5c(=O)[nH]4)CC3)n2n1
478739,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,20.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478740,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,20.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478741,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,60.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478742,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,30.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478743,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,20.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478744,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,60.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478745,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,30.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478746,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1,344.15689,[M+H]+,20.0,val,Cc1nc2ccccc2n1C1CN(Cc2ccc(OC(F)F)cc2)C1
478747,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478748,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478749,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,60.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478750,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,30.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478751,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478752,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,60.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478753,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,30.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478754,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,374.13217,[M-H]-,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478755,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,376.14672,[M+H]+,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478756,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,376.14672,[M+H]+,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478757,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,376.14672,[M+H]+,60.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478758,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,376.14672,[M+H]+,30.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478759,O=C(NCc1nc2c(COCC2)c(=O)[nH]1)C1(c2c(F)cccc2F)CCC1,376.14672,[M+H]+,20.0,val,O=C(NCc1nc2c(c(=O)[nH]1)COCC2)C1(c2c(F)cccc2F)CCC1
478760,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,20.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478761,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,20.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478762,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,45.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478763,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,60.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478764,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,20.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478765,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,45.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478766,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,60.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478767,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1,349.15222,[M+H]+,20.0,val,O=c1cccc2n1CC1CC2CN(Cc2cccc(C(F)(F)F)c2)C1
478768,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478769,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478770,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478771,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,15.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478772,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478773,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478774,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478775,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,411.09957,[M-H]-,15.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478776,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,447.07625,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478777,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,447.07625,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478778,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,447.07625,[M+Cl]-,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478779,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,447.07625,[M+Cl]-,15.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478780,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,447.07625,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478781,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,457.10505,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478782,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,457.10505,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478783,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,457.10505,[M+FA]-,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478784,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,457.10505,[M+FA]-,15.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478785,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,457.10505,[M+FA]-,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478786,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478787,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478788,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,45.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478789,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,60.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478790,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478791,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,60.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478792,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,45.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478793,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,411.09957,[M-H]-,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478794,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478795,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478796,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478797,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,30.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478798,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478799,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478800,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,30.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478801,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,413.11412,[M+H]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478802,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,430.14067,[M+NH4]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478803,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,430.14067,[M+NH4]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478804,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,430.14067,[M+NH4]+,60.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478805,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,430.14067,[M+NH4]+,15.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478806,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21,430.14067,[M+NH4]+,20.0,val,CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccc3C(F)(F)F)ccc21
478807,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478808,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478809,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,45.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478810,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,60.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478811,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478812,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,60.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478813,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,45.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478814,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1,413.11412,[M+H]+,20.0,val,Cc1ccc(N2CC(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2=O)cc1
478815,COC(=O)C1CCC(NC(=O)c2noc(-c3ccccc3C(F)(F)F)c2)CC1,397.13697,[M+H]+,20.0,val,COC(=O)C1CCC(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CC1
478816,COC(=O)C1CCC(NC(=O)c2noc(-c3ccccc3C(F)(F)F)c2)CC1,397.13697,[M+H]+,20.0,val,COC(=O)C1CCC(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CC1
478817,COC(=O)C1CCC(NC(=O)c2noc(-c3ccccc3C(F)(F)F)c2)CC1,397.13697,[M+H]+,60.0,val,COC(=O)C1CCC(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CC1
478818,COC(=O)C1CCC(NC(=O)c2noc(-c3ccccc3C(F)(F)F)c2)CC1,397.13697,[M+H]+,30.0,val,COC(=O)C1CCC(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CC1
478819,COC(=O)C1CCC(NC(=O)c2noc(-c3ccccc3C(F)(F)F)c2)CC1,397.13697,[M+H]+,20.0,val,COC(=O)C1CCC(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CC1
478820,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,20.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478821,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,20.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478822,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,60.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478823,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,20.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478824,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,45.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478825,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,60.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478826,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,20.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478827,Cc1nn2c(c1)N(C(=O)c1cc(N3CCCC3=O)ccc1)CCC2C(F)(F)F,393.15329,[M+H]+,45.0,val,Cc1cc2n(n1)C(C(F)(F)F)CCN2C(=O)c1cccc(N2CCCC2=O)c1
478828,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478829,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478830,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,60.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478831,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,30.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478832,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478833,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,60.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478834,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,30.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478835,CC1CCCC(C)N1C(=O)c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1,393.15329,[M+H]+,20.0,val,CC1CCCC(C)N1C(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
478836,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,20.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478837,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,20.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478838,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,15.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478839,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,60.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478840,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,30.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478841,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,20.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478842,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,20.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478843,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1,415.15518,[M+H]+,60.0,val,CN(c1ncccc1C(F)(F)F)C1CCCN(C(=O)Nc2c(F)cccc2F)C1
478844,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478845,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478846,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,60.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478847,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,30.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478848,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478849,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,60.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478850,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,325.13578,[M-H]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478851,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,361.11246,[M+Cl]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478852,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,361.11246,[M+Cl]-,60.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478853,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,361.11246,[M+Cl]-,15.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478854,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,361.11246,[M+Cl]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478855,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478856,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478857,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,371.14126,[M+FA]-,60.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478858,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,371.14126,[M+FA]-,15.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478859,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478860,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478861,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478862,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,60.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478863,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,30.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478864,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478865,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,60.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478866,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,325.13578,[M-H]-,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478867,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478868,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478869,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,60.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478870,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478871,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,45.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478872,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,60.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478873,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,20.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478874,CC(=O)Nc1c2CCCN(C(=O)Cc3cc(F)ccc3)c2ccc1,327.15033,[M+H]+,45.0,val,CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1cccc(F)c1
478875,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,327.15033,[M+H]+,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478876,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,327.15033,[M+H]+,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478877,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,327.15033,[M+H]+,60.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478878,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,327.15033,[M+H]+,15.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478879,O=C(Cc1cc(F)ccc1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1,327.15033,[M+H]+,20.0,val,O=C(Cc1cccc(F)c1)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1
478880,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478881,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478882,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478883,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,30.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478884,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478885,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,30.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478886,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478887,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,325.13578,[M-H]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478888,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,371.14126,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478889,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,371.14126,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478890,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,371.14126,[M+FA]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478891,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,371.14126,[M+FA]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478892,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,371.14126,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478893,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478894,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478895,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,45.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478896,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,60.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478897,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478898,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478899,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,45.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478900,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,325.13578,[M-H]-,60.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478901,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,361.11246,[M+Cl]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478902,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,361.11246,[M+Cl]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478903,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,361.11246,[M+Cl]-,15.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478904,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,361.11246,[M+Cl]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478905,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,371.14126,[M+FA]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478906,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,371.14126,[M+FA]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478907,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,371.14126,[M+FA]-,60.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478908,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,371.14126,[M+FA]-,30.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478909,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,371.14126,[M+FA]-,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478910,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478911,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478912,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478913,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,30.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478914,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478915,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,30.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478916,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478917,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,325.13578,[M-H]-,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478918,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,361.11246,[M+Cl]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478919,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,361.11246,[M+Cl]-,15.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478920,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478921,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478922,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478923,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,15.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478924,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478925,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,15.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478926,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478927,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,371.14126,[M+FA]-,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478928,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,325.13578,[M-H]-,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478929,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,325.13578,[M-H]-,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478930,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,325.13578,[M-H]-,60.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478931,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,325.13578,[M-H]-,30.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478932,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,325.13578,[M-H]-,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478933,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,325.13578,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478934,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,325.13578,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478935,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,325.13578,[M-H]-,60.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478936,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,325.13578,[M-H]-,30.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478937,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,325.13578,[M-H]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478938,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478939,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478940,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,371.14126,[M+FA]-,60.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478941,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,371.14126,[M+FA]-,15.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478942,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,371.14126,[M+FA]-,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478943,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478944,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478945,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478946,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,30.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478947,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478948,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478949,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,30.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478950,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,325.13578,[M-H]-,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478951,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478952,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478953,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478954,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478955,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478956,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478957,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478958,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,371.14126,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478959,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478960,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478961,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,45.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478962,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478963,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478964,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,60.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478965,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,45.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478966,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O,327.15033,[M+H]+,20.0,val,Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1N1CCCC1=O
478967,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478968,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478969,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,60.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478970,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,30.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478971,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478972,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,30.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478973,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,60.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478974,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1,327.15033,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
478975,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478976,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478977,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,45.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478978,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,60.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478979,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478980,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,45.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478981,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,60.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478982,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1,327.15033,[M+H]+,20.0,val,O=C(Nc1ccc(CC(=O)N2CCCC2)cc1)c1cccc(F)c1
478983,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,327.15033,[M+H]+,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478984,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,327.15033,[M+H]+,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478985,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,327.15033,[M+H]+,60.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478986,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,327.15033,[M+H]+,30.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478987,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1,327.15033,[M+H]+,20.0,val,CC(C)c1ccc(NC2CC(=O)N(c3ccc(F)cc3)C2=O)cc1
478988,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478989,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478990,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478991,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,30.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478992,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478993,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,30.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478994,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,60.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478995,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1,327.15033,[M+H]+,20.0,val,O=C(CCc1ccccc1)NC1CC(=O)N(c2ccc(F)cc2)C1
478996,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478997,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478998,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,60.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
478999,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
479000,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,60.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
479001,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1,327.15033,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)Nc1ccc(N2CCCCC2=O)cc1
479002,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479003,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479004,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,60.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479005,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,30.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479006,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479007,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,60.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479008,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,30.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479009,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2,327.15033,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(Cc1ccc(C#N)cc1F)CC2
479010,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,357.12561,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479011,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,357.12561,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479012,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,357.12561,[M-H]-,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479013,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,357.12561,[M-H]-,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479014,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,357.12561,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479015,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,403.13109,[M+FA]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479016,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,403.13109,[M+FA]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479017,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,403.13109,[M+FA]-,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479018,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,403.13109,[M+FA]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479019,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,359.14016,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479020,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,359.14016,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479021,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,359.14016,[M+H]+,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479022,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,359.14016,[M+H]+,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479023,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1,359.14016,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(F)cc1
479024,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,357.12561,[M-H]-,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479025,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,357.12561,[M-H]-,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479026,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,357.12561,[M-H]-,60.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479027,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,357.12561,[M-H]-,30.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479028,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,357.12561,[M-H]-,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479029,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479030,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479031,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,45.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479032,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,60.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479033,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479034,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,45.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479035,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,60.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479036,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O,359.14016,[M+H]+,20.0,val,COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
479037,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,304.14554,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479038,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,304.14554,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479039,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,304.14554,[M-H]-,60.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479040,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,304.14554,[M-H]-,30.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479041,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,304.14554,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479042,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,20.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479043,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,20.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479044,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,60.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479045,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,20.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479046,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,60.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479047,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1,306.16009,[M+H]+,20.0,val,O=C(c1cnc2ccccn12)N1CCC(Cc2ccccc2)C1
479048,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479049,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479050,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,60.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479051,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,30.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479052,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479053,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,60.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479054,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,30.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479055,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479056,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,328.14203,[M+Na]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479057,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,328.14203,[M+Na]+,60.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479058,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,328.14203,[M+Na]+,20.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479059,CCN(C)C(=O)c1nn(-c2ccccc2)c(-c2ccccc2)c1,328.14203,[M+Na]+,45.0,val,CCN(C)C(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
479060,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479061,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479062,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,30.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479063,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,60.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479064,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479065,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,45.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479066,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,60.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479067,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,306.16009,[M+H]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479068,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,328.14203,[M+Na]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479069,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,328.14203,[M+Na]+,30.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479070,Cc1c(-c2noc(CC3CCCc4ccccc43)n2)nccc1,328.14203,[M+Na]+,20.0,val,Cc1cccnc1-c1noc(CC2CCCc3ccccc32)n1
479071,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,306.16009,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479072,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,306.16009,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479073,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,306.16009,[M+H]+,60.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479074,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,306.16009,[M+H]+,15.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479075,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1,306.16009,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3(c4ccccc4)CCC3)cccc2[nH]1
479076,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479077,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479078,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,60.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479079,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,30.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479080,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479081,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,60.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479082,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,30.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479083,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,304.14554,[M-H]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479084,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,340.12221,[M+Cl]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479085,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,340.12221,[M+Cl]-,15.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479086,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,350.15101,[M+FA]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479087,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,350.15101,[M+FA]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479088,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,350.15101,[M+FA]-,60.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479089,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,350.15101,[M+FA]-,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479090,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479091,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479092,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,30.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479093,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,60.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479094,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479095,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,45.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479096,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,60.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479097,O=C(Cc1cc2ccccc2cc1)Nc1n[nH]c(C2CCC2)c1,306.16009,[M+H]+,20.0,val,O=C(Cc1ccc2ccccc2c1)Nc1cc(C2CCC2)[nH]n1
479098,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479099,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479100,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,60.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479101,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,30.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479102,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479103,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,60.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479104,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,30.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479105,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479106,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479107,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479108,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,304.14554,[M-H]-,45.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479109,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,304.14554,[M-H]-,60.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479110,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479111,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479112,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479113,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,45.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479114,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,60.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479115,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479116,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479117,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,45.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479118,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,304.14554,[M-H]-,60.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479119,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479120,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479121,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,45.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479122,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,60.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479123,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479124,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,45.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479125,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,60.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479126,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,304.14554,[M-H]-,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479127,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,304.14554,[M-H]-,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479128,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,304.14554,[M-H]-,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479129,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,304.14554,[M-H]-,45.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479130,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,304.14554,[M-H]-,60.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479131,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,304.14554,[M-H]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479132,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,304.14554,[M-H]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479133,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,304.14554,[M-H]-,60.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479134,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,304.14554,[M-H]-,30.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479135,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,304.14554,[M-H]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479136,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479137,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479138,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,60.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479139,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,15.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479140,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479141,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,15.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479142,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479143,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,350.15101,[M+FA]-,60.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479144,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,350.15101,[M+FA]-,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479145,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,350.15101,[M+FA]-,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479146,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,350.15101,[M+FA]-,60.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479147,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,350.15101,[M+FA]-,15.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479148,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,350.15101,[M+FA]-,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479149,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,304.14554,[M-H]-,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479150,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,304.14554,[M-H]-,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479151,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,304.14554,[M-H]-,45.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479152,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,304.14554,[M-H]-,60.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479153,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,304.14554,[M-H]-,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479154,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,304.14554,[M-H]-,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479155,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,304.14554,[M-H]-,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479156,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,304.14554,[M-H]-,45.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479157,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,304.14554,[M-H]-,60.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479158,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,304.14554,[M-H]-,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479159,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479160,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479161,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,60.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479162,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,30.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479163,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479164,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,60.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479165,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479166,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1,306.16009,[M+H]+,30.0,val,Cc1ccc(CNCc2cccc(Oc3ncccn3)c2)cc1
479167,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479168,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479169,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,45.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479170,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479171,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479172,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479173,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,45.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479174,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)c2cc(C)nn2-c2ccccc2)c1
479175,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,20.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479176,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,20.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479177,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,60.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479178,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,30.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479179,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,20.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479180,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,60.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479181,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,30.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479182,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1,306.16009,[M+H]+,20.0,val,Cc1ccn(CC(O)Cn2c3ccccc3c3ccccc32)n1
479183,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479184,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479185,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,60.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479186,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,30.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479187,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479188,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,60.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479189,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1,306.16009,[M+H]+,20.0,val,CN(Cc1ccccc1)Cc1cc(=O)nc(-c2ccccc2)[nH]1
479190,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479191,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479192,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,30.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479193,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,60.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479194,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,15.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479195,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479196,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,60.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479197,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1,306.16009,[M+H]+,20.0,val,O=C(NCCCn1ccnc1)c1ccc(-c2ccccc2)cc1
479198,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479199,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479200,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,60.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479201,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,30.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479202,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479203,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,60.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479204,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1,306.16009,[M+H]+,20.0,val,CC(C)c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1
479205,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,20.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479206,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,20.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479207,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,60.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479208,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,30.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479209,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,20.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479210,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,60.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479211,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,30.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479212,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C,306.16009,[M+H]+,20.0,val,CCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C
479213,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,20.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479214,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,20.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479215,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,45.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479216,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,60.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479217,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,20.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479218,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,45.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479219,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,20.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479220,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1,306.16009,[M+H]+,60.0,val,O=C(Cc1cccc2ccccc12)N1CC(Cn2ccnc2)C1
479221,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,288.14953,[M+H-H2O]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479222,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,288.14953,[M+H-H2O]+,45.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479223,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,288.14953,[M+H-H2O]+,60.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479224,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,288.14953,[M+H-H2O]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479225,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479226,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479227,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,60.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479228,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,30.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479229,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479230,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,60.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479231,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479232,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1,306.16009,[M+H]+,30.0,val,Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2N)c(C)c1
479233,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479234,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479235,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479236,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,30.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479237,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479238,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(C)c(C(=O)NCc2ccc(-n3ccnc3)cc2)c1
479239,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479240,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479241,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,60.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479242,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,30.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479243,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479244,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,60.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479245,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,30.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479246,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1,306.16009,[M+H]+,20.0,val,Cc1ccc(-n2cccc2CC(=O)NCc2ccncc2)cc1
479247,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479248,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479249,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479250,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,30.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479251,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479252,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,30.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479253,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,60.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479254,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1,306.16009,[M+H]+,20.0,val,Cc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(C)c1
479255,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,20.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479256,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,20.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479257,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,45.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479258,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,60.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479259,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,20.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479260,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,45.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479261,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,20.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479262,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2,306.16009,[M+H]+,60.0,val,CC(=O)Nc1nc2c(c(-c3ccccc3)c1C#N)CCCCC2
479263,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479264,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479265,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,45.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479266,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,60.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479267,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479268,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,45.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479269,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,60.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479270,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1,306.16009,[M+H]+,20.0,val,Cc1cc(C(=O)NC(C)c2ccccc2)n(-c2ccccc2)n1
479271,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479272,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479273,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,60.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479274,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,30.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479275,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479276,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,60.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479277,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,30.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479278,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C,306.16009,[M+H]+,20.0,val,Cc1cccc(N2CC(c3nc4ccccc4[nH]3)CC2=O)c1C
479279,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479280,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479281,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,45.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479282,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479283,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479284,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,45.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479285,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479286,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1,306.16009,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)c1ccc(-n2cccn2)cc1
479287,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479288,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479289,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,45.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479290,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,60.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479291,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479292,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,45.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479293,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,60.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479294,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1,306.16009,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
479295,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479296,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479297,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,60.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479298,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,15.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479299,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1,306.16009,[M+H]+,20.0,val,COc1ccccc1C(C#N)N1N=C(C)CC1c1ccccc1
479300,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479301,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479302,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,60.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479303,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,15.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479304,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479305,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,60.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479306,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,15.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479307,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,364.12376,[M-H]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479308,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,400.10043,[M+Cl]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479309,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,400.10043,[M+Cl]-,15.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479310,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,410.12923,[M+FA]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479311,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,410.12923,[M+FA]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479312,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,410.12923,[M+FA]-,60.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479313,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,410.12923,[M+FA]-,15.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479314,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,410.12923,[M+FA]-,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479315,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,366.13831,[M+H]+,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479316,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,366.13831,[M+H]+,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479317,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,366.13831,[M+H]+,60.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479318,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,366.13831,[M+H]+,30.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479319,CCc1c(C#N)c(N(C)C)nc(S[C@@H](C(N)=O)c2ccccc2)c1C#N,366.13831,[M+H]+,20.0,val,CCc1c(C#N)c(S[C@@H](C(N)=O)c2ccccc2)nc(N(C)C)c1C#N
479320,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479321,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479322,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,60.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479323,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479324,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,45.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479325,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,60.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479326,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,20.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479327,CC(C)(C)c1ccc(OCc2nn3c(-c4cnccc4)nnc3s2)cc1,366.13831,[M+H]+,45.0,val,CC(C)(C)c1ccc(OCc2nn3c(-c4cccnc4)nnc3s2)cc1
479328,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,364.12376,[M-H]-,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479329,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,364.12376,[M-H]-,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479330,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,364.12376,[M-H]-,60.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479331,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,364.12376,[M-H]-,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479332,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,364.12376,[M-H]-,45.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479333,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,366.13831,[M+H]+,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479334,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,366.13831,[M+H]+,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479335,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,366.13831,[M+H]+,60.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479336,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,366.13831,[M+H]+,30.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479337,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12,366.13831,[M+H]+,20.0,val,CSCCC(NC(=O)c1c[nH]c2ccccc12)c1nnc2ccccn12
479338,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,360.15783,[M-H]-,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479339,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,360.15783,[M-H]-,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479340,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,360.15783,[M-H]-,60.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479341,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,360.15783,[M-H]-,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479342,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,360.15783,[M-H]-,60.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479343,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479344,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479345,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,45.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479346,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,60.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479347,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479348,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,60.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479349,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,45.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479350,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1,362.17238,[M+H]+,20.0,val,CCn1cc(C2CC(=O)Nc3c2c(C)nn3-c2nc3ccccc3[nH]2)cn1
479351,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2,293.14158,[M]+,20.0,val,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2
479352,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2,293.14158,[M]+,60.0,val,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2
479353,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2,293.14158,[M]+,20.0,val,COc1cc2c3c(cc4ccccc4c3c1OC)N(C)CC2
479354,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,20.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479355,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,20.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479356,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,60.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479357,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,30.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479358,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,20.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479359,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,60.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479360,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,30.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479361,CC1=C(C(=O)OCC(C)C)C(c2c(Cl)cc(Cl)cc2)N2C(=O)CCSC2=N1,427.06444,[M+H]+,20.0,val,CC1=C(C(=O)OCC(C)C)C(c2ccc(Cl)cc2Cl)N2C(=O)CCSC2=N1
479362,O=C(c1nc(-c2ccc(Cl)cc2)ncc1)N1CCOC2(CCOCC2)C1,374.1266,[M+H]+,30.0,val,O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCOC2(CCOCC2)C1
479363,O=C(c1nc(-c2ccc(Cl)cc2)ncc1)N1CCOC2(CCOCC2)C1,374.1266,[M+H]+,30.0,val,O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCOC2(CCOCC2)C1
479364,O=C(c1nc(-c2ccc(Cl)cc2)ncc1)N1CCOC2(CCOCC2)C1,374.1266,[M+H]+,20.0,val,O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCOC2(CCOCC2)C1
479365,O=C(c1nc(-c2ccc(Cl)cc2)ncc1)N1CCOC2(CCOCC2)C1,374.1266,[M+H]+,60.0,val,O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCOC2(CCOCC2)C1
479366,O=C(c1nc(-c2ccc(Cl)cc2)ncc1)N1CCOC2(CCOCC2)C1,374.1266,[M+H]+,30.0,val,O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCOC2(CCOCC2)C1
479367,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,20.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479368,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,20.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479369,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,60.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479370,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,30.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479371,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,20.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479372,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,30.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479373,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,60.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479374,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1,374.1266,[M+H]+,20.0,val,Cn1nc(CNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1-c1ccco1
479375,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479376,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479377,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,60.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479378,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479379,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,45.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479380,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,60.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479381,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479382,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,384.12328,[M-H]-,45.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479383,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479384,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479385,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,60.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479386,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479387,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,45.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479388,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,60.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479389,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,20.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479390,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1c(-c2ccc(Cl)cc2)[nH]nc1,386.13783,[M+H]+,45.0,val,O=C(N[C@@H]1CC(Cn2ccnc2)C[C@H]1O)c1cn[nH]c1-c1ccc(Cl)cc1
479391,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,384.12328,[M-H]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479392,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,384.12328,[M-H]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479393,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,384.12328,[M-H]-,45.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479394,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,384.12328,[M-H]-,60.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479395,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,384.12328,[M-H]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479396,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,430.12876,[M+FA]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479397,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,430.12876,[M+FA]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479398,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,430.12876,[M+FA]-,60.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479399,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,430.12876,[M+FA]-,15.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479400,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,430.12876,[M+FA]-,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479401,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,386.13783,[M+H]+,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479402,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,386.13783,[M+H]+,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479403,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,386.13783,[M+H]+,60.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479404,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,386.13783,[M+H]+,30.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479405,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1,386.13783,[M+H]+,20.0,val,COc1cccc(NC(=O)C2CCN(c3nnc4c(Cl)cccn34)CC2)c1
479406,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,20.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479407,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,20.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479408,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,60.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479409,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,30.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479410,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,20.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479411,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,30.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479412,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,20.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479413,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1,392.07288,[M-H]-,60.0,val,O=C(O)C1(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)CCCCC1
479414,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479415,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479416,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479417,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479418,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,45.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479419,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479420,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479421,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,393.10899,[M-H]-,45.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479422,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,429.08567,[M+Cl]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479423,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,429.08567,[M+Cl]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479424,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,429.08567,[M+Cl]-,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479425,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,429.08567,[M+Cl]-,15.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479426,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,429.08567,[M+Cl]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479427,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,439.11447,[M+FA]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479428,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,439.11447,[M+FA]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479429,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,439.11447,[M+FA]-,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479430,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,439.11447,[M+FA]-,15.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479431,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,439.11447,[M+FA]-,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479432,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479433,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479434,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479435,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479436,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,45.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479437,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,60.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479438,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,20.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479439,NS(=O)(=O)c1c(F)ccc(C(=O)N2CCCCC2Cc2ccc(F)cc2)c1,395.12355,[M+H]+,45.0,val,NS(=O)(=O)c1cc(C(=O)N2CCCCC2Cc2ccc(F)cc2)ccc1F
479440,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479441,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479442,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,60.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479443,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479444,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,60.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479445,Cc1cc2c(c(=O)n3CCCCCc3n2)n1Cc1ccc(F)cc1,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479446,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479447,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479448,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3,326.16632,[M+H]+,60.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479449,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3,326.16632,[M+H]+,20.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479450,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3,326.16632,[M+H]+,60.0,val,Cc1cc2nc3n(c(=O)c2n1Cc1ccc(F)cc1)CCCCC3
479451,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479452,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479453,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,60.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479454,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,30.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479455,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479456,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,60.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479457,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,30.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479458,CCOc1ccc(C(=O)N2CCOC(c3cc(F)ccc3)C2)cc1,330.15,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCOC(c3cccc(F)c3)C2)cc1
479459,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479460,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479461,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,30.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479462,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,60.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479463,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,15.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479464,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479465,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,60.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479466,COc1c(C(=O)N2CCC(c3cc(F)ccc3)C2)c(OC)ccc1,330.15,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)N1CCC(c2cccc(F)c2)C1
479467,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479468,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479469,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,60.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479470,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479471,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,45.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479472,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479473,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479474,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,60.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479475,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479476,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,45.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479477,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,60.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479478,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,20.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479479,Fc1ccc([C@@H]2CCNC[C@H]2COc2cc3c(cc2)OCO3)cc1,330.15,[M+H]+,45.0,val,Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1
479480,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479481,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479482,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479483,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,30.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479484,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479485,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,30.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479486,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479487,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,328.13545,[M-H]-,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479488,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479489,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479490,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479491,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,15.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479492,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479493,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479494,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,15.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479495,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,374.14092,[M+FA]-,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479496,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,312.13944,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479497,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,312.13944,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479498,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,312.13944,[M+H-H2O]+,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479499,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,312.13944,[M+H-H2O]+,30.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479500,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,312.13944,[M+H-H2O]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479501,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,330.15,[M+H]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479502,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,330.15,[M+H]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479503,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,330.15,[M+H]+,45.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479504,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,330.15,[M+H]+,60.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479505,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F,330.15,[M+H]+,20.0,val,COc1ccc(C(=O)NCC(O)(c2ccccc2)C2CC2)cc1F
479506,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479507,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479508,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,60.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479509,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,15.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479510,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479511,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,60.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479512,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,15.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479513,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,415.09041,[M-H]-,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479514,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,417.10496,[M+H]+,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479515,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,417.10496,[M+H]+,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479516,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,417.10496,[M+H]+,60.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479517,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,417.10496,[M+H]+,15.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479518,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O,417.10496,[M+H]+,20.0,val,CCc1c(C)nc(SCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)[nH]c1=O
479519,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,387.07136,[M-H]-,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479520,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,387.07136,[M-H]-,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479521,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,387.07136,[M-H]-,60.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479522,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,387.07136,[M-H]-,30.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479523,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,387.07136,[M-H]-,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479524,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O,389.08592,[M+H]+,20.0,val,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O
479525,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O,389.08592,[M+H]+,20.0,val,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O
479526,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O,389.08592,[M+H]+,60.0,val,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O
479527,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O,389.08592,[M+H]+,20.0,val,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O
479528,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O,389.08592,[M+H]+,45.0,val,Cn1cc(C(=O)N2CCCCC2Cc2ccccc2Br)ccc1=O
479529,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,389.08592,[M+H]+,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479530,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,389.08592,[M+H]+,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479531,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,389.08592,[M+H]+,60.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479532,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,389.08592,[M+H]+,30.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479533,CC(C)(C(=O)NCc1cc2c(CCC2)[nH]c1=O)c1ccccc1Br,389.08592,[M+H]+,20.0,val,CC(C)(C(=O)NCc1cc2c([nH]c1=O)CCC2)c1ccccc1Br
479534,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21,453.04782,[M+H]+,20.0,val,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21
479535,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21,453.04782,[M+H]+,20.0,val,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21
479536,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21,453.04782,[M+H]+,60.0,val,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21
479537,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21,453.04782,[M+H]+,30.0,val,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21
479538,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21,453.04782,[M+H]+,20.0,val,COc1ccc(Br)cc1C1C(C(=O)OC(C)C)=C(C)N=C2SCCC(=O)N21
479539,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl,437.10448,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl
479540,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl,437.10448,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl
479541,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl,437.10448,[M+H]+,60.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl
479542,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl,437.10448,[M+H]+,15.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl
479543,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl,437.10448,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1nc(SC)ncc1Cl
479544,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479545,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479546,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479547,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479548,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479549,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479550,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479551,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,435.08993,[M-H]-,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479552,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,471.0666,[M+Cl]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479553,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,471.0666,[M+Cl]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479554,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,471.0666,[M+Cl]-,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479555,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479556,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479557,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479558,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479559,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479560,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479561,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479562,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,481.09541,[M+FA]-,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479563,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479564,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479565,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479566,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479567,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479568,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,15.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479569,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479570,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O,437.10448,[M+H]+,60.0,val,COc1ccc(Cl)cc1NC(=O)NCCN1c2ccccc2N(C2CC2)S1(=O)=O
479571,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,20.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479572,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,20.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479573,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,60.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479574,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,15.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479575,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,20.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479576,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,45.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479577,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,60.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479578,CNc1c2c(Cl)c[nH]c2nc(Nc2c(OC)cc(C(=O)N3CCOCC3)cc2)n1,417.14364,[M+H]+,20.0,val,CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12
479579,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479580,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479581,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479582,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,30.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479583,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479584,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,30.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479585,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479586,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,379.09539,[M-H]-,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479587,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,415.07207,[M+Cl]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479588,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,415.07207,[M+Cl]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479589,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479590,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479591,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479592,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479593,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479594,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479595,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479596,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O,425.10087,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
479597,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,417.11983,[M+Cl]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479598,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,417.11983,[M+Cl]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479599,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,417.11983,[M+Cl]-,15.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479600,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,417.11983,[M+Cl]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479601,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,427.14863,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479602,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,427.14863,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479603,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,427.14863,[M+FA]-,60.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479604,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,427.14863,[M+FA]-,15.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479605,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,427.14863,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479606,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,365.14714,[M+H-H2O]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479607,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,365.14714,[M+H-H2O]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479608,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,365.14714,[M+H-H2O]+,60.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479609,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,365.14714,[M+H-H2O]+,30.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479610,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,365.14714,[M+H-H2O]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479611,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,383.1577,[M+H]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479612,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,383.1577,[M+H]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479613,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,383.1577,[M+H]+,60.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479614,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,383.1577,[M+H]+,15.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479615,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1,383.1577,[M+H]+,20.0,val,COc1ccc(CCNC(=O)NCC(O)c2ccc(C(F)(F)F)cc2)cc1
479616,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479617,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479618,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,60.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479619,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479620,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,45.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479621,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,60.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479622,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479623,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,389.1707,[M-H]-,45.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479624,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,425.14738,[M+Cl]-,15.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479625,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,425.14738,[M+Cl]-,15.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479626,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,425.14738,[M+Cl]-,60.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479627,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,391.18525,[M+H]+,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479628,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,391.18525,[M+H]+,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479629,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,391.18525,[M+H]+,60.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479630,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,391.18525,[M+H]+,20.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479631,CCc1cncnc1N1CCN(Cc2nc3c(cc(C(F)(F)F)cc3)[nH]2)CC1,391.18525,[M+H]+,45.0,val,CCc1cncnc1N1CCN(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)CC1
479632,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479633,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479634,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,45.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479635,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,60.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479636,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479637,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,45.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479638,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,60.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479639,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,431.13071,[M-H]-,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479640,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479641,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479642,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,60.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479643,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,30.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479644,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479645,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,60.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479646,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,30.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479647,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1,433.14526,[M+H]+,20.0,val,Cc1nnc(NC(=O)CN2CCC3(CC2)NC(=O)N(Cc2ccc(F)cc2)C3=O)s1
479648,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,465.06806,[M+FA]-,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479649,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,465.06806,[M+FA]-,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479650,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,465.06806,[M+FA]-,60.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479651,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,465.06806,[M+FA]-,15.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479652,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,465.06806,[M+FA]-,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479653,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479654,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479655,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,60.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479656,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479657,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,45.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479658,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,60.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479659,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,20.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479660,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1,421.07714,[M+H]+,45.0,val,O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(I)cc1
479661,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479662,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479663,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,60.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479664,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,30.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479665,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479666,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,60.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479667,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,30.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479668,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479669,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479670,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479671,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,60.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479672,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,30.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479673,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479674,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479675,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479676,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,60.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479677,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,30.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479678,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479679,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,60.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479680,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,30.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479681,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479682,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479683,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479684,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,60.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479685,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,30.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479686,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479687,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,60.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479688,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,30.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479689,CNCCCC1c2ccccc2C=Cc2ccccc21,264.17468,[M+H]+,20.0,val,CNCCCC1c2ccccc2C=Cc2ccccc21
479690,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479691,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479692,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,60.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479693,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,30.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479694,CNCCC=C1c2ccccc2CCc2ccccc12,264.17468,[M+H]+,20.0,val,CNCCC=C1c2ccccc2CCc2ccccc21
479695,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479696,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479697,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,60.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479698,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479699,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,60.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479700,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,354.14593,[M-H]-,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479701,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479702,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479703,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,60.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479704,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479705,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,45.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479706,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,60.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479707,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,20.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479708,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1,356.16048,[M+H]+,45.0,val,COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C4CCC3CC4)cc2)[nH]1
479709,Cc1c(C(=O)N2CC(c3ccccc3)OCC2(C)C)cc([N+](=O)[O-])cn1,356.16048,[M+H]+,20.0,val,Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2ccccc2)OCC1(C)C
479710,Cc1c(C(=O)N2CC(c3ccccc3)OCC2(C)C)cc([N+](=O)[O-])cn1,356.16048,[M+H]+,20.0,val,Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2ccccc2)OCC1(C)C
479711,Cc1c(C(=O)N2CC(c3ccccc3)OCC2(C)C)cc([N+](=O)[O-])cn1,356.16048,[M+H]+,60.0,val,Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2ccccc2)OCC1(C)C
479712,Cc1c(C(=O)N2CC(c3ccccc3)OCC2(C)C)cc([N+](=O)[O-])cn1,356.16048,[M+H]+,30.0,val,Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2ccccc2)OCC1(C)C
479713,Cc1c(C(=O)N2CC(c3ccccc3)OCC2(C)C)cc([N+](=O)[O-])cn1,356.16048,[M+H]+,20.0,val,Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2ccccc2)OCC1(C)C
479714,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479715,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479716,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,60.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479717,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479718,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,45.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479719,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,60.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479720,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479721,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,354.14593,[M-H]-,45.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479722,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,356.16048,[M+H]+,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479723,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,356.16048,[M+H]+,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479724,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,356.16048,[M+H]+,60.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479725,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,356.16048,[M+H]+,15.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479726,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1,356.16048,[M+H]+,20.0,val,COc1ccc(C2=C(C(C)=O)C(C)Nc3c2c(=O)n(C)c(=O)n3C)cc1
479727,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479728,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479729,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,60.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479730,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,30.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479731,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479732,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,60.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479733,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,30.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479734,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,354.14593,[M-H]-,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479735,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,356.16048,[M+H]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479736,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,356.16048,[M+H]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479737,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,356.16048,[M+H]+,60.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479738,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,356.16048,[M+H]+,15.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479739,O=C(Cn1nc2CCCCc2cc1=O)N[C@@H](Cc1ccccc1)C(=O)O,356.16048,[M+H]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H](Cc1ccccc1)C(=O)O
479740,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,20.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479741,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,20.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479742,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,60.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479743,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,30.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479744,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,20.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479745,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,45.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479746,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,60.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479747,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12,356.16048,[M+H]+,20.0,val,CC(=O)Nc1cccc2c(C(=O)N3CCC4(CC3)OCCO4)ccnc12
479748,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2,418.09007,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2
479749,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2,418.09007,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2
479750,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2,418.09007,[M-H]-,30.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2
479751,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2,418.09007,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2
479752,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479753,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479754,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479755,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479756,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479757,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479758,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479759,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1,420.10462,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCN(c3nc4c(S(C)(=O)=O)cccc4s3)CC2)c(C)o1
479760,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2,296.1645,[M+H]+,20.0,val,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2
479761,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2,296.1645,[M+H]+,20.0,val,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2
479762,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2,296.1645,[M+H]+,60.0,val,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2
479763,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2,296.1645,[M+H]+,30.0,val,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2
479764,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2,296.1645,[M+H]+,20.0,val,COc1cc2c3c(c1OC)-c1ccccc1C[C@H]3N(C)CC2
479765,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1,296.1645,[M+H]+,20.0,val,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1
479766,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1,296.1645,[M+H]+,20.0,val,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1
479767,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1,296.1645,[M+H]+,45.0,val,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1
479768,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1,296.1645,[M+H]+,60.0,val,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1
479769,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1,296.1645,[M+H]+,20.0,val,O=C(c1ccc(OCc2ccccc2)cc1)C1CCNCC1
479770,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,326.12202,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479771,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,326.12202,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479772,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,326.12202,[M-H]-,60.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479773,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,326.12202,[M-H]-,30.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479774,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,326.12202,[M-H]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479775,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,362.0987,[M+Cl]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479776,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,362.0987,[M+Cl]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479777,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,362.0987,[M+Cl]-,15.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479778,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479779,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479780,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,60.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479781,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,15.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479782,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479783,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,15.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479784,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479785,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,372.1275,[M+FA]-,60.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479786,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1,328.13658,[M+H]+,15.0,val,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1
479787,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1,328.13658,[M+H]+,15.0,val,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1
479788,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1,328.13658,[M+H]+,60.0,val,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1
479789,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1,328.13658,[M+H]+,20.0,val,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1
479790,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1,328.13658,[M+H]+,15.0,val,CCc1ccc(C2SCC(=O)N2Cc2ccc(OC)cc2)cc1
479791,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479792,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479793,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479794,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,30.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479795,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479796,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,30.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479797,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,60.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479798,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1,310.12602,[M+H-H2O]+,20.0,val,O=C(NCC(O)c1ccc(-c2cccs2)cc1)C1CC=CCC1
479799,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,20.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479800,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,20.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479801,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,15.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479802,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,60.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479803,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,30.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479804,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,20.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479805,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,60.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479806,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC,398.1686,[M+H]+,20.0,val,COc1ccc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cc1OC
479807,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,483.18856,[M+FA]-,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479808,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,483.18856,[M+FA]-,15.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479809,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,483.18856,[M+FA]-,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479810,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479811,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479812,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,45.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479813,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479814,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479815,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,45.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479816,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,60.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479817,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F,439.19763,[M+H]+,20.0,val,CCc1ncnc(N(C)CC2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1F
479818,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,373.12275,[M-H]-,30.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479819,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,373.12275,[M-H]-,30.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479820,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,373.12275,[M-H]-,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479821,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,373.12275,[M-H]-,60.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479822,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,373.12275,[M-H]-,30.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479823,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,419.12823,[M+FA]-,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479824,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,419.12823,[M+FA]-,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479825,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,419.12823,[M+FA]-,60.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479826,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,419.12823,[M+FA]-,15.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479827,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,419.12823,[M+FA]-,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479828,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,373.12275,[M-H]-,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479829,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,373.12275,[M-H]-,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479830,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,373.12275,[M-H]-,60.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479831,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,373.12275,[M-H]-,30.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479832,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,373.12275,[M-H]-,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479833,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,419.12823,[M+FA]-,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479834,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,419.12823,[M+FA]-,60.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479835,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,419.12823,[M+FA]-,15.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479836,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,419.12823,[M+FA]-,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479837,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479838,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479839,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,60.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479840,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479841,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,45.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479842,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,60.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479843,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,20.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479844,CCS(=O)(=O)C1CCN(C(=O)c2c(Oc3ccccc3)ccnc2)CC1,375.1373,[M+H]+,45.0,val,CCS(=O)(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1
479845,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,375.1373,[M+H]+,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479846,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,375.1373,[M+H]+,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479847,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,375.1373,[M+H]+,60.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479848,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,375.1373,[M+H]+,20.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479849,COc1ccc(-c2cc(C(=O)NCC3CCS(=O)(=O)CC3)cnc2)cc1,375.1373,[M+H]+,45.0,val,COc1ccc(-c2cncc(C(=O)NCC3CCS(=O)(=O)CC3)c2)cc1
479850,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479851,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479852,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,60.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479853,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,30.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479854,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479855,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,60.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479856,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,30.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479857,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1,375.1373,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N1CCc2c(cccc2S(=O)(=O)NC)C1
479858,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479859,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479860,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,60.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479861,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,30.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479862,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479863,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,60.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479864,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,30.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479865,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,373.12275,[M-H]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479866,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,419.12823,[M+FA]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479867,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,419.12823,[M+FA]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479868,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,419.12823,[M+FA]-,60.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479869,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,419.12823,[M+FA]-,15.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479870,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1,419.12823,[M+FA]-,20.0,val,CC(NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1
479871,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,373.12275,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479872,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,373.12275,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479873,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,373.12275,[M-H]-,60.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479874,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,373.12275,[M-H]-,15.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479875,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,373.12275,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479876,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,419.12823,[M+FA]-,15.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479877,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,419.12823,[M+FA]-,15.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479878,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,419.12823,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479879,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,419.12823,[M+FA]-,60.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479880,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,419.12823,[M+FA]-,15.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479881,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479882,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479883,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479884,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,30.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479885,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479886,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,30.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479887,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479888,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,373.12275,[M-H]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479889,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,409.09943,[M+Cl]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479890,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,409.09943,[M+Cl]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479891,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,409.09943,[M+Cl]-,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479892,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,409.09943,[M+Cl]-,15.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479893,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,409.09943,[M+Cl]-,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479894,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479895,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479896,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,45.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479897,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,60.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479898,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479899,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,45.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479900,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479901,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,373.12275,[M-H]-,60.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479902,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,409.09943,[M+Cl]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479903,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,409.09943,[M+Cl]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479904,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,409.09943,[M+Cl]-,60.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479905,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,409.09943,[M+Cl]-,15.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479906,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,409.09943,[M+Cl]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479907,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,419.12823,[M+FA]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479908,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,419.12823,[M+FA]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479909,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,419.12823,[M+FA]-,60.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479910,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,419.12823,[M+FA]-,15.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479911,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,419.12823,[M+FA]-,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479912,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,373.12275,[M-H]-,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479913,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,373.12275,[M-H]-,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479914,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,373.12275,[M-H]-,60.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479915,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,373.12275,[M-H]-,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479916,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,373.12275,[M-H]-,60.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479917,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.1373,[M+H]+,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479918,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.1373,[M+H]+,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479919,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.1373,[M+H]+,60.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479920,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.1373,[M+H]+,30.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479921,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1,375.1373,[M+H]+,20.0,val,O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1
479922,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC,375.1373,[M+H]+,20.0,val,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC
479923,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC,375.1373,[M+H]+,20.0,val,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC
479924,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC,375.1373,[M+H]+,60.0,val,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC
479925,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC,375.1373,[M+H]+,30.0,val,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC
479926,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC,375.1373,[M+H]+,20.0,val,COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccc(C)c3)C2)cc1OC
479927,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479928,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479929,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,60.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479930,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,30.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479931,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479932,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,60.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479933,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,30.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479934,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1,375.1373,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1
479935,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,375.1373,[M+H]+,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479936,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,375.1373,[M+H]+,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479937,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,375.1373,[M+H]+,60.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479938,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,375.1373,[M+H]+,15.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479939,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1,375.1373,[M+H]+,20.0,val,COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1
479940,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479941,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479942,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479943,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,30.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479944,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479945,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,30.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479946,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479947,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,375.1373,[M+H]+,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479948,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,397.11925,[M+Na]+,45.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479949,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,397.11925,[M+Na]+,45.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479950,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,397.11925,[M+Na]+,45.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479951,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,397.11925,[M+Na]+,60.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479952,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O,397.11925,[M+Na]+,20.0,val,COc1ccc(NS(=O)(=O)CCc2ccccc2)cc1N1CCCC1=O
479953,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479954,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479955,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479956,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,15.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479957,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479958,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,45.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479959,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,45.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479960,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479961,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,60.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479962,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,45.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479963,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479964,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,60.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479965,CC(C)=CCC/C(C)=C/Cc1c2oc(=O)ccc2ccc1O,297.14962,[M-H]-,45.0,val,CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
479966,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,297.14962,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
479967,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,297.14962,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
479968,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,297.14962,[M-H]-,60.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
479969,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,297.14962,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
479970,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,297.14962,[M-H]-,45.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
479971,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479972,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479973,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479974,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,30.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479975,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479976,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479977,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,30.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479978,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,297.14962,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479979,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,333.1263,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479980,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,333.1263,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479981,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,333.1263,[M+Cl]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479982,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,333.1263,[M+Cl]-,15.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479983,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,333.1263,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479984,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,343.1551,[M+FA]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479985,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,343.1551,[M+FA]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479986,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,343.1551,[M+FA]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479987,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,343.1551,[M+FA]-,15.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479988,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1,343.1551,[M+FA]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1
479989,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479990,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479991,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479992,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,15.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479993,CC(C)=CCC/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1
479994,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,20.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
479995,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,20.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
479996,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,60.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
479997,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,20.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
479998,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,45.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
479999,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,60.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
480000,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,20.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
480001,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O,316.19072,[M+NH4]+,45.0,val,C=CC(C)(C)c1cc2cc(CC=C(C)C)c(O)cc2oc1=O
480002,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
480003,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
480004,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,299.16417,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
480005,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,299.16417,[M+H]+,30.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
480006,CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(=O)ccc2c1,299.16417,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/Cc1cc2ccc(=O)oc2cc1O
480007,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480008,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480009,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,60.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480010,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480011,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,45.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480012,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,60.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480013,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480014,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,313.14453,[M-H]-,45.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480015,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,349.12121,[M+Cl]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480016,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,359.15001,[M+FA]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480017,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,359.15001,[M+FA]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480018,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,359.15001,[M+FA]-,60.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480019,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,359.15001,[M+FA]-,15.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480020,COc1c(O)cc2c(c1)CC(C)C(C)C2c1cc(O)c(O)cc1,359.15001,[M+FA]-,20.0,val,COc1cc2c(cc1O)C(c1ccc(O)c(O)c1)C(C)C(C)C2
480021,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480022,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480023,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,60.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480024,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,30.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480025,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480026,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,60.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480027,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,30.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480028,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480029,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480030,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480031,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,349.12121,[M+Cl]-,60.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480032,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,349.12121,[M+Cl]-,15.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480033,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480034,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,359.15001,[M+FA]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480035,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,359.15001,[M+FA]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480036,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,359.15001,[M+FA]-,60.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480037,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,359.15001,[M+FA]-,30.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480038,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1,359.15001,[M+FA]-,20.0,val,O=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1
480039,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480040,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480041,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,313.14453,[M-H]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480042,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,313.14453,[M-H]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480043,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,313.14453,[M-H]-,45.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480044,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480045,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480046,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,349.12121,[M+Cl]-,60.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480047,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,349.12121,[M+Cl]-,15.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480048,O=C(CCCCc1ccc(O)cc1)CCc1cc(O)c(O)cc1,349.12121,[M+Cl]-,20.0,val,O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)c(O)c1
480049,CC(C)=CCc1c2oc(=O)ccc2cc2c1OC(C(C)(C)O)C2,315.15909,[M+H]+,20.0,val,CC(C)=CCc1c2c(cc3ccc(=O)oc13)CC(C(C)(C)O)O2
480050,CC(C)=CCc1c2oc(=O)ccc2cc2c1OC(C(C)(C)O)C2,315.15909,[M+H]+,20.0,val,CC(C)=CCc1c2c(cc3ccc(=O)oc13)CC(C(C)(C)O)O2
480051,CC(C)=CCc1c2oc(=O)ccc2cc2c1OC(C(C)(C)O)C2,315.15909,[M+H]+,60.0,val,CC(C)=CCc1c2c(cc3ccc(=O)oc13)CC(C(C)(C)O)O2
480052,CC(C)=CCc1c2oc(=O)ccc2cc2c1OC(C(C)(C)O)C2,315.15909,[M+H]+,30.0,val,CC(C)=CCc1c2c(cc3ccc(=O)oc13)CC(C(C)(C)O)O2
480053,CC(C)=CCc1c2oc(=O)ccc2cc2c1OC(C(C)(C)O)C2,315.15909,[M+H]+,20.0,val,CC(C)=CCc1c2c(cc3ccc(=O)oc13)CC(C(C)(C)O)O2
480054,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480055,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480056,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,60.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480057,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,15.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480058,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480059,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,60.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480060,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,15.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480061,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,297.14853,[M+H-H2O]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480062,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,332.18563,[M+NH4]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480063,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,332.18563,[M+NH4]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480064,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,332.18563,[M+NH4]+,60.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480065,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,332.18563,[M+NH4]+,30.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480066,CC(C)=CC(O)C/C(C)=C/COc1cc2c(cc1)ccc(=O)o2,332.18563,[M+NH4]+,20.0,val,CC(C)=CC(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
480067,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480068,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480069,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,60.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480070,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,30.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480071,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480072,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,60.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480073,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,30.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480074,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,315.15909,[M+H]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480075,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,332.18563,[M+NH4]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480076,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,332.18563,[M+NH4]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480077,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,332.18563,[M+NH4]+,60.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480078,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,332.18563,[M+NH4]+,15.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480079,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,332.18563,[M+NH4]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480080,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,337.14103,[M+Na]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480081,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,337.14103,[M+Na]+,60.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480082,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2cocc2)C1=O,337.14103,[M+Na]+,20.0,val,CC1=CC(=O)C[C@H]2[C@@H]1CC[C@@H](C)[C@]21CO[C@H](c2ccoc2)C1=O
480083,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3,315.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3
480084,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3,315.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3
480085,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3,315.15909,[M+H]+,60.0,val,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3
480086,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3,315.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3
480087,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3,315.15909,[M+H]+,45.0,val,C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@H](C(C)(C)O)C3
480088,COc1c(OCCCc2ccccc2)cc(CCC(=O)O)cc1,313.14453,[M-H]-,20.0,val,COc1ccc(CCC(=O)O)cc1OCCCc1ccccc1
480089,COc1c(OCCCc2ccccc2)cc(CCC(=O)O)cc1,313.14453,[M-H]-,20.0,val,COc1ccc(CCC(=O)O)cc1OCCCc1ccccc1
480090,COc1c(OCCCc2ccccc2)cc(CCC(=O)O)cc1,313.14453,[M-H]-,60.0,val,COc1ccc(CCC(=O)O)cc1OCCCc1ccccc1
480091,COc1c(OCCCc2ccccc2)cc(CCC(=O)O)cc1,313.14453,[M-H]-,30.0,val,COc1ccc(CCC(=O)O)cc1OCCCc1ccccc1
480092,COc1c(OCCCc2ccccc2)cc(CCC(=O)O)cc1,313.14453,[M-H]-,20.0,val,COc1ccc(CCC(=O)O)cc1OCCCc1ccccc1
480093,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,469.02607,[M-H]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480094,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,469.02607,[M-H]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480095,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,469.02607,[M-H]-,45.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480096,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,469.02607,[M-H]-,60.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480097,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,469.02607,[M-H]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480098,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,505.00275,[M+Cl]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480099,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,505.00275,[M+Cl]-,15.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480100,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480101,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480102,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,60.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480103,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,15.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480104,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480105,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,60.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480106,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480107,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,515.03155,[M+FA]-,15.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480108,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,471.04062,[M+H]+,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480109,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,471.04062,[M+H]+,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480110,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,471.04062,[M+H]+,60.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480111,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,471.04062,[M+H]+,30.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480112,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1,471.04062,[M+H]+,20.0,val,Cc1ccccc1CNC(=O)C1(C)CCN(S(=O)(=O)c2ccc(Br)s2)CC1
480113,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,20.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480114,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,20.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480115,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,30.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480116,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,60.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480117,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,15.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480118,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,20.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480119,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,60.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480120,Cc1c(Cl)c(OCCCN2CCCCC2)nc(-c2ccc(F)cc2)n1,364.15864,[M+H]+,20.0,val,Cc1nc(-c2ccc(F)cc2)nc(OCCCN2CCCCC2)c1Cl
480121,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,429.16428,[M+FA]-,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480122,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,429.16428,[M+FA]-,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480123,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,429.16428,[M+FA]-,60.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480124,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,429.16428,[M+FA]-,15.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480125,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,429.16428,[M+FA]-,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480126,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,419.13548,[M+Cl]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480127,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,419.13548,[M+Cl]-,60.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480128,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,419.13548,[M+Cl]-,15.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480129,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,419.13548,[M+Cl]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480130,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480131,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480132,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,60.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480133,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,15.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480134,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480135,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,60.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480136,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,15.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480137,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,429.16428,[M+FA]-,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480138,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480139,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480140,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,60.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480141,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,30.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480142,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480143,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,60.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480144,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,30.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480145,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1,385.17335,[M+H]+,20.0,val,CC(Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1
480146,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480147,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480148,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,60.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480149,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,30.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480150,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480151,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,60.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480152,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,30.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480153,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1,385.17335,[M+H]+,20.0,val,O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCOCC1
480154,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,383.1588,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480155,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,383.1588,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480156,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,383.1588,[M-H]-,60.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480157,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,383.1588,[M-H]-,30.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480158,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,383.1588,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480159,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,385.17335,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480160,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,385.17335,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480161,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,385.17335,[M+H]+,30.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480162,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,385.17335,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480163,Cc1cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(C(C)C)cc1,385.17335,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1
480164,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480165,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480166,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,60.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480167,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,30.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480168,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480169,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,60.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480170,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,30.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480171,COc1cc(=O)n(CCNC(=O)CCc2cc(C)c(F)cc2)c(C)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480172,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480173,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480174,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1,347.17655,[M+H]+,60.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480175,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1,347.17655,[M+H]+,30.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480176,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1,347.17655,[M+H]+,20.0,val,COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1
480177,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480178,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480179,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,60.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480180,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,30.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480181,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480182,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,30.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480183,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,60.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480184,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1,347.17655,[M+H]+,20.0,val,CC1=C(C(=O)OCC2CCCCC2)C(c2ccccc2F)NC(=O)N1
480185,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,324.17175,[M-H]-,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480186,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,324.17175,[M-H]-,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480187,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,324.17175,[M-H]-,45.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480188,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,324.17175,[M-H]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480189,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,324.17175,[M-H]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480190,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,324.17175,[M-H]-,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480191,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,324.17175,[M-H]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480192,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,324.17175,[M-H]-,45.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480193,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,370.17723,[M+FA]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480194,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,370.17723,[M+FA]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480195,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,370.17723,[M+FA]-,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480196,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,370.17723,[M+FA]-,15.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480197,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,370.17723,[M+FA]-,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480198,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,324.17175,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480199,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,324.17175,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480200,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,324.17175,[M-H]-,60.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480201,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,324.17175,[M-H]-,30.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480202,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,324.17175,[M-H]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480203,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,370.17723,[M+FA]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480204,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,370.17723,[M+FA]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480205,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,370.17723,[M+FA]-,60.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480206,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,370.17723,[M+FA]-,15.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480207,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,370.17723,[M+FA]-,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480208,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,324.17175,[M-H]-,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480209,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,324.17175,[M-H]-,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480210,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,324.17175,[M-H]-,60.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480211,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,370.17723,[M+FA]-,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480212,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,370.17723,[M+FA]-,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480213,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,370.17723,[M+FA]-,60.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480214,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,370.17723,[M+FA]-,15.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480215,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,370.17723,[M+FA]-,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480216,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480217,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480218,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,30.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480219,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,60.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480220,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,15.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480221,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480222,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,60.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480223,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,326.1863,[M+H]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480224,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,348.16825,[M+Na]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480225,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,348.16825,[M+Na]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480226,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,348.16825,[M+Na]+,60.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480227,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,348.16825,[M+Na]+,30.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480228,Cc1c(C(=O)N2CCC(Oc3ccccn3)C2)ccc(C(C)C)n1,348.16825,[M+Na]+,20.0,val,Cc1nc(C(C)C)ccc1C(=O)N1CCC(Oc2ccccn2)C1
480229,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480230,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480231,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480232,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480233,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,45.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480234,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480235,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480236,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1,326.1863,[M+H]+,45.0,val,Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCC(CO)CC1
480237,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1,326.1863,[M+H]+,20.0,val,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1
480238,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1,326.1863,[M+H]+,20.0,val,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1
480239,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1,326.1863,[M+H]+,60.0,val,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1
480240,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1,326.1863,[M+H]+,30.0,val,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1
480241,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1,326.1863,[M+H]+,20.0,val,O=C(CCC1CCNC1)Nc1ccc(OCc2ccncc2)cc1
480242,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1,326.1863,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1
480243,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1,326.1863,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1
480244,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1,326.1863,[M+H]+,60.0,val,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1
480245,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1,326.1863,[M+H]+,15.0,val,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1
480246,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1,326.1863,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N[C@@H]2C=C[C@H](CO)C2)nn1-c1ccccc1
480247,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,20.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480248,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,20.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480249,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,60.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480250,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,15.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480251,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,20.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480252,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,60.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480253,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,15.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480254,CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3cc2)CC1,326.1863,[M+H]+,20.0,val,CNC(=O)C1CCN(C(=O)CCc2ccc3ccccc3n2)CC1
480255,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480256,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480257,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,60.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480258,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480259,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,45.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480260,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,60.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480261,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,20.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480262,Cc1c(C(=O)N2CCCC3c4c(CCC32)n(C)cn4)cc(O)cc1,326.1863,[M+H]+,45.0,val,Cc1ccc(O)cc1C(=O)N1CCCC2c3ncn(C)c3CCC21
480263,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480264,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480265,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480266,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,30.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480267,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480268,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480269,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,30.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480270,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,308.17574,[M+H-H2O]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480271,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,326.1863,[M+H]+,15.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480272,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,326.1863,[M+H]+,15.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480273,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,326.1863,[M+H]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480274,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,326.1863,[M+H]+,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480275,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,326.1863,[M+H]+,15.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480276,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480277,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480278,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480279,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,30.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480280,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480281,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,60.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480282,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,30.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480283,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2,348.16825,[M+Na]+,20.0,val,O=C(NCC1(C(O)c2ccccc2)CC1)c1n[nH]c2c1CCCC2
480284,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,20.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480285,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,20.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480286,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,60.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480287,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,30.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480288,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,20.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480289,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,60.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480290,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,30.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480291,O=C(c1c(C2CC2)oc(C2CC2)c1)N1CCCC(c2ccn[nH]2)C1,326.1863,[M+H]+,20.0,val,O=C(c1cc(C2CC2)oc1C1CC1)N1CCCC(c2ccn[nH]2)C1
480292,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480293,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480294,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,60.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480295,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,30.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480296,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480297,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,60.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480298,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,30.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480299,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1,326.1863,[M+H]+,20.0,val,CCN(CCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1
480300,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480301,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480302,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,60.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480303,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,30.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480304,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480305,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,60.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480306,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,30.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480307,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CC2CCC2(Nc2nc3ccccc3o2)C1
480308,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,324.17175,[M-H]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480309,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,324.17175,[M-H]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480310,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,324.17175,[M-H]-,60.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480311,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,324.17175,[M-H]-,30.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480312,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,324.17175,[M-H]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480313,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,360.14843,[M+Cl]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480314,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,360.14843,[M+Cl]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480315,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,360.14843,[M+Cl]-,60.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480316,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,360.14843,[M+Cl]-,15.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480317,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,360.14843,[M+Cl]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480318,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,370.17723,[M+FA]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480319,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,370.17723,[M+FA]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480320,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,370.17723,[M+FA]-,60.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480321,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,370.17723,[M+FA]-,15.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480322,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,370.17723,[M+FA]-,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480323,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,326.1863,[M+H]+,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480324,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,326.1863,[M+H]+,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480325,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,326.1863,[M+H]+,60.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480326,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,326.1863,[M+H]+,30.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480327,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1,326.1863,[M+H]+,20.0,val,Nc1ccccc1NC(=O)CCCCCC(=O)Nc1ccccc1
480328,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,325.17848,[M]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480329,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,325.17848,[M]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480330,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,325.17848,[M]+,60.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480331,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,325.17848,[M]+,30.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480332,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,325.17848,[M]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480333,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,326.1863,[M+H]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480334,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,326.1863,[M+H]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480335,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,326.1863,[M+H]+,60.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480336,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,326.1863,[M+H]+,20.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480337,COc1cc2c(cc1)CN(C(=O)C1CCc3c(C1)[nH]c(C)n3)CC2,326.1863,[M+H]+,45.0,val,COc1ccc2c(c1)CCN(C(=O)C1CCc3nc(C)[nH]c3C1)C2
480338,C=CC(C)(C)c1c(C[C@@H]2NC(=O)[C@H](C)NC2=O)c2ccccc2[nH]1,326.1863,[M+H]+,20.0,val,C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](C)NC1=O
480339,C=CC(C)(C)c1c(C[C@@H]2NC(=O)[C@H](C)NC2=O)c2ccccc2[nH]1,326.1863,[M+H]+,20.0,val,C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](C)NC1=O
480340,C=CC(C)(C)c1c(C[C@@H]2NC(=O)[C@H](C)NC2=O)c2ccccc2[nH]1,326.1863,[M+H]+,60.0,val,C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](C)NC1=O
480341,C=CC(C)(C)c1c(C[C@@H]2NC(=O)[C@H](C)NC2=O)c2ccccc2[nH]1,326.1863,[M+H]+,15.0,val,C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](C)NC1=O
480342,C=CC(C)(C)c1c(C[C@@H]2NC(=O)[C@H](C)NC2=O)c2ccccc2[nH]1,326.1863,[M+H]+,20.0,val,C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](C)NC1=O
480343,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,370.17723,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480344,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,370.17723,[M+FA]-,60.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480345,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,370.17723,[M+FA]-,15.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480346,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,370.17723,[M+FA]-,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480347,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,324.17175,[M-H]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480348,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,324.17175,[M-H]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480349,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,324.17175,[M-H]-,60.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480350,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,324.17175,[M-H]-,30.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480351,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,324.17175,[M-H]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480352,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,360.14843,[M+Cl]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480353,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,360.14843,[M+Cl]-,15.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480354,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,360.14843,[M+Cl]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480355,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480356,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480357,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,60.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480358,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,15.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480359,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480360,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,60.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480361,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,15.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480362,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,370.17723,[M+FA]-,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480363,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480364,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480365,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,45.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480366,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480367,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480368,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480369,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,45.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480370,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,324.17175,[M-H]-,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480371,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480372,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480373,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480374,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,15.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480375,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480376,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,15.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480377,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480378,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480379,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,370.17723,[M+FA]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480380,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,370.17723,[M+FA]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480381,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,370.17723,[M+FA]-,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480382,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,370.17723,[M+FA]-,15.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480383,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,370.17723,[M+FA]-,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480384,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,324.17175,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480385,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,324.17175,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480386,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,324.17175,[M-H]-,45.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480387,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,324.17175,[M-H]-,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480388,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,324.17175,[M-H]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480389,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,360.14843,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480390,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,360.14843,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480391,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,360.14843,[M+Cl]-,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480392,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,360.14843,[M+Cl]-,15.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480393,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,360.14843,[M+Cl]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480394,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480395,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480396,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480397,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,15.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480398,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480399,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,15.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480400,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480401,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,370.17723,[M+FA]-,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480402,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480403,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480404,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,45.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480405,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480406,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480407,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480408,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,324.17175,[M-H]-,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480409,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480410,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480411,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480412,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,15.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480413,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480414,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,15.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480415,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,360.14843,[M+Cl]-,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480416,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480417,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480418,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480419,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,30.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480420,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480421,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,30.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480422,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,60.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480423,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1
480424,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480425,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480426,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,60.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480427,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,30.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480428,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480429,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,30.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480430,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,60.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480431,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1
480432,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480433,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480434,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,45.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480435,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,60.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480436,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480437,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,60.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480438,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,45.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480439,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1,326.1863,[M+H]+,20.0,val,CC(C)c1ccc(OCC(=O)NC2CN(c3ccccn3)C2)cc1
480440,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C,326.1863,[M+H]+,20.0,val,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C
480441,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C,326.1863,[M+H]+,20.0,val,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C
480442,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C,326.1863,[M+H]+,60.0,val,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C
480443,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C,326.1863,[M+H]+,15.0,val,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C
480444,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C,326.1863,[M+H]+,20.0,val,CC(C)n1cccc1CNC(=O)COc1cccc2c1ccn2C
480445,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480446,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480447,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480448,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480449,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480450,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,20.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480451,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,45.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480452,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1,326.1863,[M+H]+,60.0,val,O=C(Cn1cnc2c(c1=O)CCCC2)NCCCc1ccccc1
480453,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480454,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480455,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,60.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480456,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,30.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480457,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480458,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,30.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480459,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,20.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480460,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1,326.1863,[M+H]+,60.0,val,CCC(C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1
480461,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480462,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480463,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,60.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480464,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,30.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480465,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480466,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,30.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480467,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,60.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480468,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1,326.1863,[M+H]+,20.0,val,CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2ccccn2)cc1
480469,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480470,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480471,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,60.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480472,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,30.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480473,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480474,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,60.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480475,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,30.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480476,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1,326.1863,[M+H]+,20.0,val,CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1
480477,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480478,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480479,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480480,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,30.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480481,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480482,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,30.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480483,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,60.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480484,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1,326.1863,[M+H]+,20.0,val,CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccncc2)cc1
480485,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480486,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480487,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,45.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480488,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,60.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480489,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480490,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,20.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480491,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,45.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480492,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1,326.1863,[M+H]+,60.0,val,O=C(C1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1
480493,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480494,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480495,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,15.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480496,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,60.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480497,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,30.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480498,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480499,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,45.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480500,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,60.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480501,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2,326.1863,[M+H]+,20.0,val,COc1cc2c(cc1OC)CN(c1ncnc3c1CCCC3)CC2
480502,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480503,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480504,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,60.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480505,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,30.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480506,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480507,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,30.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480508,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,20.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480509,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1,326.1863,[M+H]+,60.0,val,O=C(C1CCCC1)N1CCC(c2noc(-c3ccccc3)n2)CC1
480510,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480511,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480512,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480513,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480514,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480515,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480516,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480517,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2,326.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)N1C2CCC1CC(n1cccn1)C2
480518,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480519,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480520,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480521,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,30.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480522,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480523,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,30.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480524,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,20.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480525,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1,326.1863,[M+H]+,60.0,val,O=C(NCc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1
480526,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480527,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480528,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,60.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480529,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,30.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480530,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480531,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,60.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480532,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480533,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1,326.1863,[M+H]+,30.0,val,Cc1cc(OCC2CCN(C(=O)Cc3cccnc3)CC2)ccn1
480534,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,20.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480535,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,20.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480536,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,45.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480537,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,60.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480538,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,20.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480539,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,45.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480540,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,60.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480541,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1,326.1863,[M+H]+,20.0,val,COc1cccc(-c2cn3c(n2)N(C(=O)C2CCCC2)CCC3)c1
480542,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480543,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480544,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,60.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480545,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,30.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480546,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480547,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,20.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480548,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,60.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480549,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1,326.1863,[M+H]+,30.0,val,O=C(NCCN1CCOCC1)N(c1ccccc1)c1ccccc1
480550,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,20.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480551,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,20.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480552,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,60.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480553,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,15.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480554,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,20.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480555,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,60.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480556,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,15.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480557,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1,326.1863,[M+H]+,20.0,val,Cc1cc(C)nc(OC2CCCN(C(=O)c3ccccc3C)C2)n1
480558,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3c(C)ccc(C)c3)C(=O)N(C)C1=N2,367.1877,[M]+,20.0,val,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3cc(C)ccc3C)C(=O)N(C)C1=N2
480559,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3c(C)ccc(C)c3)C(=O)N(C)C1=N2,367.1877,[M]+,20.0,val,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3cc(C)ccc3C)C(=O)N(C)C1=N2
480560,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3c(C)ccc(C)c3)C(=O)N(C)C1=N2,367.1877,[M]+,60.0,val,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3cc(C)ccc3C)C(=O)N(C)C1=N2
480561,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3c(C)ccc(C)c3)C(=O)N(C)C1=N2,367.1877,[M]+,30.0,val,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3cc(C)ccc3C)C(=O)N(C)C1=N2
480562,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3c(C)ccc(C)c3)C(=O)N(C)C1=N2,367.1877,[M]+,20.0,val,CC1=NNC2=[N+](C1C)C1C(=O)N(Cc3cc(C)ccc3C)C(=O)N(C)C1=N2
480563,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,20.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480564,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,20.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480565,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,60.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480566,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,15.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480567,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,20.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480568,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,60.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480569,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,15.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480570,CC(C)Oc1c(C(=O)NC(c2nc(C3CC3)no2)C(C)C)cc(Cl)cc1,378.15789,[M+H]+,20.0,val,CC(C)Oc1ccc(Cl)cc1C(=O)NC(c1nc(C2CC2)no1)C(C)C
480571,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,20.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480572,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,20.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480573,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,60.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480574,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,30.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480575,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,20.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480576,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,60.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480577,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,30.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480578,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1,378.15789,[M+H]+,20.0,val,CC(C)OC(=O)NC1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1
480579,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,20.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480580,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,20.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480581,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,60.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480582,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,15.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480583,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,20.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480584,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,60.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480585,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,15.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480586,Cc1c2c(N)c(C(=O)NC3CC3)sc2nc(OCC(=O)N2CCN(C)CC2)c1Cl,438.13611,[M+H]+,20.0,val,Cc1c(Cl)c(OCC(=O)N2CCN(C)CC2)nc2sc(C(=O)NC3CC3)c(N)c12
480587,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1,399.15485,[M+H]+,20.0,val,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1
480588,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1,399.15485,[M+H]+,20.0,val,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1
480589,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1,399.15485,[M+H]+,60.0,val,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1
480590,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1,399.15485,[M+H]+,30.0,val,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1
480591,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1,399.15485,[M+H]+,20.0,val,O=C(C1CC1c1c(F)cccc1F)N1CCC(N2CCS(=O)(=O)CC2)CC1
480592,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480593,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480594,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,60.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480595,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480596,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,45.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480597,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,60.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480598,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480599,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,360.17289,[M-H]-,45.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480600,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,20.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480601,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,20.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480602,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,60.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480603,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,30.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480604,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,20.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480605,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,60.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480606,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,30.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480607,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1,362.18745,[M+H]+,20.0,val,CCCc1nc(C(=O)NCC(c2ccc(F)cc2)N2CCOCC2)co1
480608,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,362.18745,[M+H]+,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480609,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,362.18745,[M+H]+,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480610,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,362.18745,[M+H]+,60.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480611,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,362.18745,[M+H]+,15.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480612,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3c2cc(F)cc3)C1=O,362.18745,[M+H]+,20.0,val,CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCc3ccc(F)cc32)C1=O
480613,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,20.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480614,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,20.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480615,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,60.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480616,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,30.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480617,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,20.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480618,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,60.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480619,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,30.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480620,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12,297.19614,[M+H]+,20.0,val,CC(NC(=O)C1CCCC1CN)c1cccc2ccccc12
480621,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480622,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480623,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,60.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480624,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480625,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,60.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480626,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480627,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480628,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480629,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,60.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480630,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480631,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,45.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480632,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,60.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480633,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2,297.19614,[M+H]+,20.0,val,O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2
480634,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,279.18558,[M+H-H2O]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480635,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,279.18558,[M+H-H2O]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480636,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,279.18558,[M+H-H2O]+,60.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480637,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,279.18558,[M+H-H2O]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480638,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,279.18558,[M+H-H2O]+,60.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480639,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480640,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480641,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,60.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480642,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480643,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,45.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480644,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,60.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480645,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,20.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480646,CCC12CCCN3CCc4c(C31)n(c1ccccc41)C(O)C2,297.19614,[M+H]+,45.0,val,CCC12CCCN3CCc4c(n(c5ccccc45)C(O)C1)C32
480647,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,20.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480648,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,20.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480649,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,45.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480650,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,60.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480651,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,20.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480652,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,45.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480653,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,60.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480654,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21,297.19614,[M+H]+,20.0,val,CCN(CC)CC(O)Cn1c2ccccc2c2ccccc21
480655,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480656,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480657,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480658,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,15.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480659,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480660,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480661,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480662,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480663,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,30.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480664,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480665,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480666,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480667,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480668,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,15.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480669,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480670,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480671,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,15.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480672,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,383.18961,[M-H]-,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480673,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480674,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480675,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480676,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,30.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480677,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480678,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,60.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480679,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,30.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480680,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccnc1)B(O)O,367.1936,[M+H-H2O]+,20.0,val,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
480681,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480682,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480683,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,45.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480684,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,60.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480685,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480686,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,45.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480687,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,60.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480688,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1,377.1223,[M+H]+,20.0,val,O=C(CCc1ccccc1Br)N1CC(N2CC3CCCC3C2)C1
480689,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480690,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480691,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,60.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480692,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480693,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,45.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480694,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,60.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480695,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480696,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,422.13913,[M-H]-,45.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480697,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,424.15368,[M+H]+,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480698,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,424.15368,[M+H]+,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480699,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,424.15368,[M+H]+,60.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480700,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,424.15368,[M+H]+,15.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480701,CCCOc1cc(OCCC)c(C(=O)NS(=O)(=O)c2c3OCCCn3nc2)cc1,424.15368,[M+H]+,20.0,val,CCCOc1ccc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(OCCC)c1
480702,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,346.14824,[M-H]-,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480703,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480704,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480705,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,60.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480706,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,15.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480707,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480708,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,60.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480709,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,15.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480710,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,392.15372,[M+FA]-,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480711,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,347.15497,[M]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480712,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,347.15497,[M]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480713,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,347.15497,[M]+,60.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480714,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,347.15497,[M]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480715,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,347.15497,[M]+,45.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480716,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480717,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480718,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,30.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480719,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,60.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480720,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,15.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480721,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480722,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,60.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480723,Cc1cc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)ccc1,348.16279,[M+H]+,20.0,val,Cc1cccc(C2(CNC(=O)CC3C=CS(=O)(=O)C3)CCCC2)c1
480724,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480725,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480726,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,60.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480727,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,15.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480728,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480729,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480730,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,15.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480731,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,392.15372,[M+FA]-,60.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480732,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480733,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480734,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,60.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480735,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,30.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480736,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480737,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,60.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480738,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,30.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480739,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1,348.16279,[M+H]+,20.0,val,CCOc1ccc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2c1
480740,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480741,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480742,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,60.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480743,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,30.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480744,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480745,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,30.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480746,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,20.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480747,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1,348.16279,[M+H]+,60.0,val,COc1ccc(CCC(=O)NCCC(CCO)c2cccs2)cc1
480748,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,20.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480749,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,20.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480750,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,60.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480751,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,15.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480752,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,20.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480753,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,60.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480754,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,20.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480755,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12,348.16279,[M+H]+,15.0,val,CCN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c2ccccc12
480756,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480757,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480758,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,60.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480759,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,30.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480760,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480761,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,60.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480762,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,30.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480763,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1,398.21622,[M+H]+,20.0,val,CCC(CC)n1nc(C)cc1C(=O)N1CCCC(n2ccc(C(F)(F)F)n2)C1
480764,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480765,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480766,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,60.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480767,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,30.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480768,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480769,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,60.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480770,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,20.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480771,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F,344.2245,[M+H]+,30.0,val,CC(C)c1ncnc(N(C)C2CCCN(Cc3ccccn3)C2)c1F
480772,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1,379.1686,[M+H]+,30.0,val,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1
480773,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1,379.1686,[M+H]+,30.0,val,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1
480774,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1,379.1686,[M+H]+,20.0,val,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1
480775,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1,379.1686,[M+H]+,60.0,val,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1
480776,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1,379.1686,[M+H]+,30.0,val,O=C(CS(=O)(=O)C1CCCC1)N1CCCN(C(=O)c2ccccc2)CC1
480777,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,20.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480778,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,20.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480779,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,60.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480780,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,30.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480781,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,20.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480782,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,60.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480783,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,30.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480784,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2,379.1686,[M+H]+,20.0,val,CSc1cc2c(cc1NC(=O)N1CCC(C3CCOCC3)C1)OCCO2
480785,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,20.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480786,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,20.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480787,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,60.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480788,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,20.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480789,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,45.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480790,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,60.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480791,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,20.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480792,CCCOc1cc2c(cc1)cc(S(=O)(=O)N1CCN(CCO)CC1)cc2,379.1686,[M+H]+,45.0,val,CCCOc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1
480793,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,379.1686,[M+H]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480794,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,379.1686,[M+H]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480795,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,379.1686,[M+H]+,60.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480796,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,379.1686,[M+H]+,30.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480797,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,379.1686,[M+H]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480798,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,401.15055,[M+Na]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480799,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,401.15055,[M+Na]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480800,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,401.15055,[M+Na]+,60.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480801,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21,401.15055,[M+Na]+,20.0,val,CC(C)CCn1ccc2c(OCC(=O)NC3CCS(=O)(=O)C3)cccc21
480802,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,361.1769,[M-H]-,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480803,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,361.1769,[M-H]-,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480804,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,361.1769,[M-H]-,60.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480805,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,361.1769,[M-H]-,15.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480806,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,361.1769,[M-H]-,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480807,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,363.19145,[M+H]+,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480808,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,363.19145,[M+H]+,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480809,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,363.19145,[M+H]+,60.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480810,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,363.19145,[M+H]+,15.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480811,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O,363.19145,[M+H]+,20.0,val,CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O
480812,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480813,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480814,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,60.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480815,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,30.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480816,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480817,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,60.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480818,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,30.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480819,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,393.14897,[M-H]-,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480820,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,395.16352,[M+H]+,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480821,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,395.16352,[M+H]+,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480822,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,395.16352,[M+H]+,60.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480823,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,395.16352,[M+H]+,15.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480824,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1,395.16352,[M+H]+,20.0,val,O=C(O)c1ccccc1C1CCN(C(=O)NCC2CCCCS2(=O)=O)CC1
480825,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,405.1602,[M-H]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480826,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,405.1602,[M-H]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480827,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,405.1602,[M-H]-,60.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480828,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,405.1602,[M-H]-,15.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480829,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,405.1602,[M-H]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480830,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,441.13688,[M+Cl]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480831,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,441.13688,[M+Cl]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480832,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,441.13688,[M+Cl]-,60.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480833,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,441.13688,[M+Cl]-,15.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480834,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,441.13688,[M+Cl]-,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480835,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480836,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480837,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,60.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480838,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,30.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480839,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480840,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,60.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480841,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,30.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480842,CCCc1nn(C)c(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)c1,407.17475,[M+H]+,20.0,val,CCCc1cc(C(=O)Nc2ccc(CS(=O)(=O)N3CCOCC3)cc2)n(C)n1
480843,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,405.1602,[M-H]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480844,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,405.1602,[M-H]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480845,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,405.1602,[M-H]-,60.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480846,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,405.1602,[M-H]-,15.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480847,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,405.1602,[M-H]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480848,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,451.16568,[M+FA]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480849,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,451.16568,[M+FA]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480850,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,451.16568,[M+FA]-,60.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480851,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,451.16568,[M+FA]-,15.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480852,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,451.16568,[M+FA]-,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480853,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480854,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480855,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,60.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480856,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,30.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480857,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480858,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,30.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480859,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,60.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480860,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1,407.17475,[M+H]+,20.0,val,CC1CCN(CCNC(=O)c2nc(CCS(=O)(=O)c3ccccc3)no2)CC1
480861,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,385.19936,[M-H]-,30.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480862,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,385.19936,[M-H]-,30.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480863,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,385.19936,[M-H]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480864,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,385.19936,[M-H]-,60.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480865,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,385.19936,[M-H]-,30.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480866,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,421.17604,[M+Cl]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480867,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,421.17604,[M+Cl]-,15.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480868,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,421.17604,[M+Cl]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480869,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480870,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480871,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,60.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480872,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,15.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480873,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480874,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,60.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480875,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,15.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480876,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,431.20484,[M+FA]-,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480877,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480878,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480879,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,60.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480880,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,30.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480881,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480882,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,60.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480883,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,30.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480884,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2cnc(N3CCOCC3)cc2)cn1,387.21391,[M+H]+,20.0,val,Cn1cc([C@H]2OCCC[C@@H]2NC(=O)Nc2ccc(N3CCOCC3)nc2)cn1
480885,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,20.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480886,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,20.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480887,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,60.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480888,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,15.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480889,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,20.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480890,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,60.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480891,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,15.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480892,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1,348.17231,[M+H]+,20.0,val,CC(C)C(O)P(=O)(OCc1ccccc1)c1ccc(N(C)C)cc1
480893,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,395.17114,[M+FA]-,20.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480894,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,395.17114,[M+FA]-,60.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480895,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,395.17114,[M+FA]-,15.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480896,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,395.17114,[M+FA]-,20.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480897,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,368.20676,[M+NH4]+,20.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480898,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,368.20676,[M+NH4]+,20.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480899,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,368.20676,[M+NH4]+,60.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480900,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,368.20676,[M+NH4]+,15.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480901,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21,368.20676,[M+NH4]+,20.0,val,C=C(C)C(=O)OC1CC(CO)CCC/C(CO)=C/C2OC(=O)C(=C)C21
480902,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,397.15041,[M-H]-,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480903,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,397.15041,[M-H]-,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480904,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,397.15041,[M-H]-,60.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480905,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,397.15041,[M-H]-,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480906,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,397.15041,[M-H]-,45.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480907,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,399.16496,[M+H]+,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480908,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,399.16496,[M+H]+,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480909,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,399.16496,[M+H]+,60.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480910,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,399.16496,[M+H]+,15.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480911,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C,399.16496,[M+H]+,20.0,val,C=C(COC(=O)C(O)C(O)CO)C12OC1C1(C)C(=CC2=O)C(O)C(O)CC1C
480912,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,441.16134,[M-H]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480913,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,441.16134,[M-H]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480914,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,441.16134,[M-H]-,60.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480915,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,441.16134,[M-H]-,30.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480916,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,441.16134,[M-H]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480917,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,477.13802,[M+Cl]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480918,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,477.13802,[M+Cl]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480919,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,477.13802,[M+Cl]-,60.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480920,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,477.13802,[M+Cl]-,15.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480921,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,477.13802,[M+Cl]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480922,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,487.16682,[M+FA]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480923,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,487.16682,[M+FA]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480924,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,487.16682,[M+FA]-,60.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480925,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,487.16682,[M+FA]-,15.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480926,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O,487.16682,[M+FA]-,20.0,val,CN1c2cc(F)c(NC(=O)C3CCCN(C(=O)OC(C)(C)C)C3)cc2N(C)S1(=O)=O
480927,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480928,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480929,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,45.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480930,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,60.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480931,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480932,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,45.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480933,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480934,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1,358.20599,[M+H]+,60.0,val,CC(C)(C)c1cc(N2CCN(Cc3csc(C4CC4)n3)CC2)ncn1
480935,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,332.16897,[M-H]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480936,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,332.16897,[M-H]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480937,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,332.16897,[M-H]-,60.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480938,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,332.16897,[M-H]-,30.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480939,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,332.16897,[M-H]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480940,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,368.14565,[M+Cl]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480941,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,378.17445,[M+FA]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480942,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,378.17445,[M+FA]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480943,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,378.17445,[M+FA]-,60.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480944,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,378.17445,[M+FA]-,15.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480945,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,378.17445,[M+FA]-,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480946,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,334.18353,[M+H]+,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480947,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,334.18353,[M+H]+,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480948,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,334.18353,[M+H]+,60.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480949,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,334.18353,[M+H]+,30.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480950,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1,334.18353,[M+H]+,20.0,val,C[S+]([O-])Cc1cccc(NC(=O)C2CCC3CCCCC3C2)c1
480951,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480952,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480953,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,45.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480954,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,60.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480955,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480956,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,60.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480957,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,45.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480958,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCN(CC(O)COc2ccc(C(C)=O)cc2)CC1
480959,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480960,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480961,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,60.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480962,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,30.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480963,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480964,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,60.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480965,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,30.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480966,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1,350.1962,[M+H]+,20.0,val,CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)c(OCC)c2)C1
480967,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480968,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480969,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,60.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480970,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,30.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480971,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480972,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,60.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480973,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,30.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480974,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,382.16827,[M+H]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480975,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,399.19482,[M+NH4]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480976,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,399.19482,[M+NH4]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480977,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,399.19482,[M+NH4]+,60.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480978,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,399.19482,[M+NH4]+,15.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480979,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1,399.19482,[M+NH4]+,20.0,val,COCCN(C(=O)C1CC(C)(C)Oc2ccccc21)C1CCS(=O)(=O)C1
480980,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480981,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480982,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,60.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480983,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,30.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480984,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480985,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,30.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480986,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480987,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,380.15372,[M-H]-,60.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480988,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480989,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480990,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,60.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480991,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,15.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480992,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480993,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,60.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480994,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,20.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480995,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C,382.16827,[M+H]+,15.0,val,CCc1c(C)sc(NC(=O)C2CCCCC2C(=O)O)c1C(=O)OC(C)C
480996,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,410.18521,[M+FA]-,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
480997,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,410.18521,[M+FA]-,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
480998,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,410.18521,[M+FA]-,60.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
480999,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,410.18521,[M+FA]-,15.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481000,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,410.18521,[M+FA]-,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481001,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481002,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481003,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,15.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481004,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,60.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481005,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,30.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481006,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481007,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,60.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481008,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1,366.19428,[M+H]+,20.0,val,CC(C)(O)CN1CCN(C(=O)NC2CC(c3ccc(Cl)cc3)C2)CC1
481009,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,400.15324,[M-H]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481010,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,400.15324,[M-H]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481011,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,400.15324,[M-H]-,60.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481012,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,400.15324,[M-H]-,15.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481013,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,400.15324,[M-H]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481014,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,436.12992,[M+Cl]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481015,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,436.12992,[M+Cl]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481016,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,436.12992,[M+Cl]-,60.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481017,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,436.12992,[M+Cl]-,15.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481018,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,436.12992,[M+Cl]-,20.0,val,CO[C@@H]1[C@H](OC(=O)NC(=O)CCl)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
481019,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481020,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481021,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,60.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481022,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,30.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481023,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481024,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,60.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481025,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,30.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481026,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1ccc(C)c(C(=O)NCC2(N3CCOCC3)CCSCC2)c1
481027,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1,349.19442,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1
481028,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1,349.19442,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1
481029,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1,349.19442,[M+H]+,45.0,val,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1
481030,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1,349.19442,[M+H]+,60.0,val,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1
481031,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1,349.19442,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)N1CCCN(C2CCSCC2)CC1
481032,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,20.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481033,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,20.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481034,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,60.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481035,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,30.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481036,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,20.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481037,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,45.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481038,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,60.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481039,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2,349.19442,[M+H]+,20.0,val,CN(C)C(=O)c1cc2c(s1)CCC(C(=O)NC1CCCCCC1)C2
481040,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481041,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481042,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,60.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481043,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,30.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481044,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481045,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,60.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481046,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,20.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481047,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1,349.19442,[M+H]+,30.0,val,Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1
481048,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,20.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481049,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,20.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481050,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,60.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481051,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,30.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481052,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,20.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481053,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,60.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481054,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,30.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481055,CC1(C)Cc2c(sc(Cn3cc(C4(O)CCOCC4)nn3)n2)C(C)(C)C1,377.20057,[M+H]+,20.0,val,CC1(C)Cc2nc(Cn3cc(C4(O)CCOCC4)nn3)sc2C(C)(C)C1
481056,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,463.14571,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481057,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,463.14571,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481058,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,463.14571,[M-H]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481059,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,463.14571,[M-H]-,30.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481060,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,463.14571,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481061,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,509.15119,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481062,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,509.15119,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481063,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,509.15119,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481064,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,509.15119,[M+FA]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481065,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,509.15119,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481066,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,463.14571,[M-H]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481067,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,463.14571,[M-H]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481068,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,463.14571,[M-H]-,60.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481069,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,463.14571,[M-H]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481070,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,463.14571,[M-H]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481071,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,463.14571,[M-H]-,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481072,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,463.14571,[M-H]-,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481073,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,463.14571,[M-H]-,60.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481074,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,463.14571,[M-H]-,30.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481075,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,463.14571,[M-H]-,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481076,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,482.18681,[M+NH4]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481077,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,482.18681,[M+NH4]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481078,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,482.18681,[M+NH4]+,60.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481079,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,482.18681,[M+NH4]+,15.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481080,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,482.18681,[M+NH4]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O
481081,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,482.18681,[M+NH4]+,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481082,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,482.18681,[M+NH4]+,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481083,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,482.18681,[M+NH4]+,60.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481084,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,482.18681,[M+NH4]+,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481085,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O,482.18681,[M+NH4]+,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)O
481086,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,482.18681,[M+NH4]+,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481087,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,482.18681,[M+NH4]+,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481088,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,482.18681,[M+NH4]+,60.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481089,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,482.18681,[M+NH4]+,15.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481090,COc1c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)cc(O)c1,482.18681,[M+NH4]+,20.0,val,COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC
481091,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481092,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481093,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,45.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481094,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481095,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481096,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481097,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481098,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1,376.21656,[M+H]+,45.0,val,CN1CCN(CC#CCOC2CCN(c3nc(C4CC4)ns3)CC2)CC1
481099,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,391.23508,[M+FA]-,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481100,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,391.23508,[M+FA]-,60.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481101,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,391.23508,[M+FA]-,15.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481102,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,391.23508,[M+FA]-,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481103,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481104,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481105,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,60.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481106,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481107,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,45.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481108,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,60.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481109,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,20.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481110,CCC1(C)CN(C(=O)NCc2cc(N3CCCC3)nc(C)c2)CCO1,347.24415,[M+H]+,45.0,val,CCC1(C)CN(C(=O)NCc2cc(C)nc(N3CCCC3)c2)CCO1
481111,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,20.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481112,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,20.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481113,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,60.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481114,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,30.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481115,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,20.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481116,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1,347.24415,[M+H]+,60.0,val,Cn1cc(CN2CCN(C(=O)C3CCCO3)CC2)c(C2CCCC2)n1
481117,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,20.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481118,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,20.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481119,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,60.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481120,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,20.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481121,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,45.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481122,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,60.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481123,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,20.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481124,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,347.24415,[M+H]+,45.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481125,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1,369.22609,[M+Na]+,20.0,val,CN(C)c1cccc(CNC(=O)C2CCCN(C(=O)C(C)(C)C)C2)n1
481126,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481127,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481128,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,60.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481129,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,30.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481130,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481131,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,30.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481132,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,60.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481133,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1,347.24415,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3C(=O)C2CCOCC2)nn1
481134,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481135,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481136,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,60.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481137,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,30.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481138,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481139,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,45.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481140,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,60.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481141,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N,347.24415,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1N
481142,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC,442.21949,[M+FA]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC
481143,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC,442.21949,[M+FA]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC
481144,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC,442.21949,[M+FA]-,60.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC
481145,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC,442.21949,[M+FA]-,15.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC
481146,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC,442.21949,[M+FA]-,20.0,val,CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC
481147,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,20.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481148,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,20.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481149,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,60.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481150,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,20.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481151,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,45.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481152,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,60.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481153,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,20.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481154,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1,338.23258,[M+H]+,45.0,val,COc1cccc(OC)c1OCCOCCN1CC(C)CC(C)C1
481155,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,20.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481156,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,20.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481157,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,60.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481158,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,20.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481159,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,45.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481160,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,60.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481161,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,20.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481162,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1,320.26964,[M+H]+,45.0,val,CN(CC12CC3CC(CC(C3)C1)C2)C(=O)CN1CCC(N)CC1
481163,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,20.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481164,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,20.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481165,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,60.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481166,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,20.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481167,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,60.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481168,CCCCCCCCCCCCCCCC[N+](C)(C)C,284.33118,[M]+,20.0,val,CCCCCCCCCCCCCCCC[N+](C)(C)C
481169,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,20.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481170,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,20.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481171,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,60.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481172,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,20.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481173,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,20.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481174,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12,321.07326,[M-H]-,60.0,val,Oc1c(F)cc2ccccc2c1-c1c(O)c(F)cc2ccccc12
481175,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481176,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481177,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,60.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481178,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481179,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,75.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481180,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,60.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481181,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481182,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,350.09106,[M-H]-,75.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481183,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481184,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481185,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,60.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481186,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481187,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,75.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481188,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,60.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481189,Fc1ccc(-c2c(-c3ccncc3)[nH]c(-c3c(F)cccc3F)n2)cc1,352.10561,[M+H]+,20.0,val,Fc1ccc(-c2nc(-c3c(F)cccc3F)[nH]c2-c2ccncc2)cc1
481190,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,469.07408,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481191,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,469.07408,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481192,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,469.07408,[M-H]-,60.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481193,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,469.07408,[M-H]-,15.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481194,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,469.07408,[M-H]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481195,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,505.05076,[M+Cl]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481196,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,505.05076,[M+Cl]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481197,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,505.05076,[M+Cl]-,60.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481198,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,505.05076,[M+Cl]-,15.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481199,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,505.05076,[M+Cl]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481200,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,515.07956,[M+FA]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481201,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,515.07956,[M+FA]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481202,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,515.07956,[M+FA]-,60.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481203,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,515.07956,[M+FA]-,15.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481204,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,515.07956,[M+FA]-,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481205,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481206,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481207,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,60.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481208,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481209,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,45.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481210,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,60.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481211,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,20.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481212,O=C(Nc1cn(Cc2c(C(F)(F)F)cc(C(F)(F)F)cc2)nc1)c1noc(-c2ccco2)c1,471.08864,[M+H]+,45.0,val,O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1
481213,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1,360.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1
481214,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1,360.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1
481215,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1,360.09788,[M+H]+,45.0,val,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1
481216,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1,360.09788,[M+H]+,60.0,val,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1
481217,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1,360.09788,[M+H]+,20.0,val,CCc1nc2cc(-c3noc(-c4cc5ccccc5oc4=O)n3)ccc2o1
481218,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481219,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481220,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481221,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,15.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481222,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481223,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481224,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,15.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481225,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481226,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481227,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481228,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481229,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481230,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481231,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481232,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481233,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,15.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481234,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481235,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481236,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,15.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481237,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1138.50475,[M-H]-,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481238,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481239,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1140.5193,[M+H]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481240,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1157.54585,[M+NH4]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481241,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1157.54585,[M+NH4]+,60.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481242,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I,1157.54585,[M+NH4]+,20.0,val,O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
481243,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,20.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481244,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,20.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481245,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,60.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481246,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,20.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481247,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,75.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481248,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,60.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481249,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,20.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481250,N=c1ccc2c(-c3ccccc3C(=O)O)c3c(cc(N)cc3)oc-2c1,331.10772,[M+H]+,75.0,val,N=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N)cc3oc-2c1
481251,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481252,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481253,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,60.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481254,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481255,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481256,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,329.09317,[M-H]-,60.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481257,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,365.06984,[M+Cl]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481258,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,365.06984,[M+Cl]-,20.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481259,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O,365.06984,[M+Cl]-,60.0,val,CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc3ccccc3c1)C2=O
481260,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481261,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481262,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481263,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481264,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481265,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481266,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481267,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481268,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481269,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481270,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481271,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481272,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481273,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481274,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481275,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481276,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481277,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481278,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481279,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481280,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481281,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481282,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481283,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481284,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481285,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481286,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481287,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481288,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481289,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481290,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,416.08953,[M-H]-,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481291,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,452.06621,[M+Cl]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481292,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,452.06621,[M+Cl]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481293,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,452.06621,[M+Cl]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481294,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,452.06621,[M+Cl]-,15.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481295,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,462.09501,[M+FA]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481296,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,462.09501,[M+FA]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481297,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,462.09501,[M+FA]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481298,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,462.09501,[M+FA]-,15.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481299,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,462.09501,[M+FA]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481300,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481301,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481302,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,416.08953,[M-H]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481303,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,416.08953,[M-H]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481304,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,416.08953,[M-H]-,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481305,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,462.09501,[M+FA]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481306,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,462.09501,[M+FA]-,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481307,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,462.09501,[M+FA]-,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481308,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481309,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481310,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481311,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481312,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481313,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481314,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481315,FC(F)(F)c1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cc2)cn1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481316,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481317,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481318,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481319,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481320,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481321,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,60.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481322,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,20.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481323,FC(F)(F)c1ncc(CNc2ncc(Cc3c[nH]c4c3cc(Cl)cn4)cc2)cc1,418.10408,[M+H]+,45.0,val,FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
481324,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1,447.02345,[M+H]+,20.0,val,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1
481325,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1,447.02345,[M+H]+,20.0,val,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1
481326,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1,447.02345,[M+H]+,60.0,val,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1
481327,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1,447.02345,[M+H]+,15.0,val,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1
481328,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1,447.02345,[M+H]+,20.0,val,O=C(OCCN(C1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1)c1cccs1
481329,C[C@@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481330,C[C@@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481331,C[C@@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,60.0,val,C[C@@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481332,C[C@@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,30.0,val,C[C@@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481333,C[C@@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481334,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481335,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481336,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,60.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481337,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,30.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481338,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481339,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,60.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481340,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,30.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481341,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,404.10276,[M-H]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481342,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,440.07944,[M+Cl]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481343,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,440.07944,[M+Cl]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481344,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,440.07944,[M+Cl]-,60.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481345,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,440.07944,[M+Cl]-,15.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481346,C[C@](O)(Cn1ccc2c1ccc(F)c2)C(=O)Nc1cc(C(F)(F)F)c(C#N)cc1,440.07944,[M+Cl]-,20.0,val,C[C@](O)(Cn1ccc2cc(F)ccc21)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
481347,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481348,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481349,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,60.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481350,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,30.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481351,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481352,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,30.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481353,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,60.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481354,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br,414.03355,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc3c(c2)OCCO3)cc2ccccc2c1Br
481355,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,380.08074,[M-H]-,20.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481356,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,380.08074,[M-H]-,20.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481357,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,380.08074,[M-H]-,60.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481358,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,380.08074,[M-H]-,30.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481359,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,380.08074,[M-H]-,20.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481360,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,382.09529,[M+H]+,30.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481361,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,382.09529,[M+H]+,30.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481362,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,382.09529,[M+H]+,60.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481363,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,382.09529,[M+H]+,20.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481364,CC(=O)C1=NN(c2c(C)c(Cl)ccc2)C2C(=O)N(c3ccccc3)C(=O)C12,382.09529,[M+H]+,30.0,val,CC(=O)C1=NN(c2cccc(Cl)c2C)C2C(=O)N(c3ccccc3)C(=O)C12
481365,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,449.0656,[M+Cl]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481366,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,449.0656,[M+Cl]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481367,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,449.0656,[M+Cl]-,60.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481368,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,449.0656,[M+Cl]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481369,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481370,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481371,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,60.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481372,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,15.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481373,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481374,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481375,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,15.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481376,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,459.09441,[M+FA]-,60.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481377,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,415.10348,[M+H]+,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481378,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,415.10348,[M+H]+,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481379,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,415.10348,[M+H]+,45.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481380,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,415.10348,[M+H]+,60.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481381,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12,415.10348,[M+H]+,20.0,val,Cc1nnc2ccc(S(=O)(=O)N(Cc3ccccc3)c3cc(F)cc(F)c3)cn12
481382,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,442.12448,[M-H]-,45.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481383,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,442.12448,[M-H]-,45.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481384,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,442.12448,[M-H]-,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481385,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,442.12448,[M-H]-,60.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481386,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,442.12448,[M-H]-,45.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481387,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,478.10116,[M+Cl]-,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481388,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,488.12996,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481389,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,488.12996,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481390,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,488.12996,[M+FA]-,60.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481391,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,488.12996,[M+FA]-,15.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481392,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,488.12996,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481393,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481394,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481395,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,60.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481396,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481397,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,45.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481398,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,60.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481399,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,20.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481400,O=[N+]([O-])c1ccc(CNc2c3[nH]cnc3nc(NCc3cc(C(F)(F)F)ccc3)n2)cc1,444.13903,[M+H]+,45.0,val,O=[N+]([O-])c1ccc(CNc2nc(NCc3cccc(C(F)(F)F)c3)nc3nc[nH]c23)cc1
481401,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1,444.13903,[M+H]+,20.0,val,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1
481402,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1,444.13903,[M+H]+,20.0,val,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1
481403,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1,444.13903,[M+H]+,45.0,val,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1
481404,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1,444.13903,[M+H]+,60.0,val,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1
481405,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1,444.13903,[M+H]+,20.0,val,O=C(c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCN(c2ccccn2)CC1
481406,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1,379.09356,[M-H]-,20.0,val,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
481407,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1,379.09356,[M-H]-,20.0,val,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
481408,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1,379.09356,[M-H]-,60.0,val,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
481409,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1,379.09356,[M-H]-,30.0,val,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
481410,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1,379.09356,[M-H]-,20.0,val,O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
481411,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,427.02989,[M-H]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481412,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,427.02989,[M-H]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481413,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,427.02989,[M-H]-,60.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481414,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,427.02989,[M-H]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481415,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,463.00657,[M+Cl]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481416,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,463.00657,[M+Cl]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481417,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,463.00657,[M+Cl]-,60.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481418,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,463.00657,[M+Cl]-,15.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481419,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,463.00657,[M+Cl]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481420,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,473.03537,[M+FA]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481421,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,473.03537,[M+FA]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481422,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,473.03537,[M+FA]-,60.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481423,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,473.03537,[M+FA]-,30.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481424,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,473.03537,[M+FA]-,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481425,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,429.04444,[M+H]+,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481426,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,429.04444,[M+H]+,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481427,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,429.04444,[M+H]+,60.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481428,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,429.04444,[M+H]+,30.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481429,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1,429.04444,[M+H]+,20.0,val,COC(=O)c1cc(OCC(=O)Nc2ccc(Br)cc2)c2cc(C)ccc2n1
481430,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481431,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481432,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,395.09164,[M-H]-,60.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481433,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,395.09164,[M-H]-,15.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481434,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481435,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481436,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481437,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,397.10619,[M+H]+,60.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481438,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481439,COc1cc2c(cc1)-n1c(C)nnc1[C@H](CC(=O)O)N=C2c1ccc(Cl)cc1,397.10619,[M+H]+,45.0,val,COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2
481440,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481441,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481442,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,60.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481443,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,30.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481444,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481445,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,60.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481446,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,30.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481447,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,395.09164,[M-H]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481448,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,431.06832,[M+Cl]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481449,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,431.06832,[M+Cl]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481450,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,431.06832,[M+Cl]-,60.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481451,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,431.06832,[M+Cl]-,15.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481452,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,431.06832,[M+Cl]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481453,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,441.09712,[M+FA]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481454,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,441.09712,[M+FA]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481455,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,441.09712,[M+FA]-,60.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481456,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,441.09712,[M+FA]-,15.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481457,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,441.09712,[M+FA]-,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481458,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481459,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481460,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,397.10619,[M+H]+,60.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481461,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,397.10619,[M+H]+,15.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481462,O=C(Cn1c(=O)cnc2c1ccc(C(=O)NC1CC1)c2)Nc1ccc(Cl)cc1,397.10619,[M+H]+,20.0,val,O=C(Cn1c(=O)cnc2cc(C(=O)NC3CC3)ccc21)Nc1ccc(Cl)cc1
481463,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,20.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481464,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,20.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481465,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,60.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481466,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,20.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481467,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,45.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481468,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,60.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481469,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,20.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481470,O=c1oc2c(ccc(OCc3ccccc3Cl)c2)c2c1CCCC2,341.0939,[M+H]+,45.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481471,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2,341.0939,[M+H]+,45.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481472,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2,341.0939,[M+H]+,45.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481473,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2,341.0939,[M+H]+,45.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481474,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2,341.0939,[M+H]+,60.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481475,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2,341.0939,[M+H]+,20.0,val,O=c1oc2cc(OCc3ccccc3Cl)ccc2c2c1CCCC2
481476,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1,402.12599,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1
481477,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1,402.12599,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1
481478,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1,402.12599,[M+H]+,45.0,val,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1
481479,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1,402.12599,[M+H]+,60.0,val,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1
481480,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1,402.12599,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3cc(F)cc(F)c3)c(N3CCOCC3)nc2c1
481481,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,459.02111,[M-H]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481482,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,459.02111,[M-H]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481483,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,459.02111,[M-H]-,60.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481484,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,459.02111,[M-H]-,30.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481485,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,459.02111,[M-H]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481486,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,505.02659,[M+FA]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481487,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,505.02659,[M+FA]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481488,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,505.02659,[M+FA]-,60.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481489,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,505.02659,[M+FA]-,15.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481490,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,505.02659,[M+FA]-,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481491,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,461.03567,[M+H]+,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481492,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,461.03567,[M+H]+,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481493,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,461.03567,[M+H]+,60.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481494,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,461.03567,[M+H]+,30.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481495,COc1ccc(N2C(=O)c3c(ccc(I)c3)NC2c2ccc(C)o2)cc1,461.03567,[M+H]+,20.0,val,COc1ccc(N2C(=O)c3cc(I)ccc3NC2c2ccc(C)o2)cc1
481496,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,20.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481497,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,20.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481498,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,60.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481499,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,30.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481500,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,20.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481501,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,60.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481502,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,30.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481503,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1,300.14952,[M+H]+,20.0,val,c1ccc2nc(CNCc3ccc4ccccc4n3)ccc2c1
481504,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481505,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481506,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481507,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481508,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,45.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481509,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481510,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481511,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,346.10196,[M-H]-,45.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481512,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,382.07863,[M+Cl]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481513,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,382.07863,[M+Cl]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481514,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,382.07863,[M+Cl]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481515,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,392.10744,[M+FA]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481516,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,392.10744,[M+FA]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481517,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,392.10744,[M+FA]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481518,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,392.10744,[M+FA]-,15.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481519,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,392.10744,[M+FA]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481520,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481521,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481522,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481523,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481524,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,45.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481525,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481526,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481527,Cc1cc2c(cc1)nc(-c1ccc(NC(=O)Cc3cccs3)cc1)[nH]2,348.11651,[M+H]+,45.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481528,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481529,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481530,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,45.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481531,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,60.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481532,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481533,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481534,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,45.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481535,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,346.10196,[M-H]-,60.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481536,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481537,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481538,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,45.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481539,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,60.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481540,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481541,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,45.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481542,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,60.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481543,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,346.10196,[M-H]-,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481544,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,346.10196,[M-H]-,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481545,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,346.10196,[M-H]-,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481546,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,346.10196,[M-H]-,60.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481547,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,346.10196,[M-H]-,30.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481548,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,346.10196,[M-H]-,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481549,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481550,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481551,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481552,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481553,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481554,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,346.10196,[M-H]-,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481555,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,346.10196,[M-H]-,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481556,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,346.10196,[M-H]-,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481557,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,346.10196,[M-H]-,45.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481558,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,346.10196,[M-H]-,60.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481559,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,392.10744,[M+FA]-,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481560,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,392.10744,[M+FA]-,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481561,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,392.10744,[M+FA]-,60.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481562,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,392.10744,[M+FA]-,15.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481563,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,392.10744,[M+FA]-,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481564,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481565,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481566,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,45.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481567,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,60.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481568,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481569,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,60.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481570,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,45.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481571,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1,348.11651,[M+H]+,20.0,val,Cc1ccccc1NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1
481572,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,20.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481573,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,20.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481574,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,45.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481575,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,60.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481576,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,20.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481577,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,60.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481578,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,45.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481579,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12,348.11651,[M+H]+,20.0,val,Cc1cccc2cc3c(N)c(C(=O)NCc4ccccc4)sc3nc12
481580,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,20.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481581,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,20.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481582,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,60.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481583,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,30.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481584,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,20.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481585,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,60.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481586,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,30.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481587,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1,348.11651,[M+H]+,20.0,val,Cc1ccnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)c1
481588,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481589,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481590,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,45.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481591,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481592,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481593,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,60.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481594,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1,348.11651,[M+H]+,20.0,val,Cc1ccc2nc(-c3ccc(NC(=O)Cc4cccs4)cc3)[nH]c2c1
481595,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481596,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481597,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,45.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481598,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,60.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481599,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481600,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,60.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481601,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,45.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481602,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1,348.11651,[M+H]+,20.0,val,Cc1cccc(NCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1
481603,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481604,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481605,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,45.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481606,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,60.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481607,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481608,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,60.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481609,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)Nc2cccc(-c3cn4ccsc4n3)c2)cc1C
481610,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481611,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481612,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,60.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481613,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,30.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481614,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481615,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,30.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481616,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,20.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481617,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O,348.11651,[M+H]+,60.0,val,CCC1SC(N/N=C/c2c3ccccc3cc3ccccc23)=NC1=O
481618,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C
481619,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C
481620,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C,348.11651,[M+H]+,45.0,val,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C
481621,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C,348.11651,[M+H]+,60.0,val,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C
481622,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C,348.11651,[M+H]+,20.0,val,Cc1ccc(C(=O)CSc2nnc3ccc4ccccc4n23)cc1C
481623,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,20.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481624,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,20.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481625,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,75.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481626,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,60.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481627,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,20.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481628,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,20.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481629,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,60.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481630,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1,328.15567,[M+H]+,75.0,val,Cc1cc(C)nc(Nc2nc(-c3ccccc3)c3ccccc3n2)n1
481631,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481632,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481633,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,60.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481634,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481635,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,45.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481636,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,60.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481637,Cc1cc2c(cc1)c(=O)nc(Nc1nc(C)cc(-c3ccccc3)n1)[nH]2,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481638,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481639,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481640,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,45.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481641,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,60.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481642,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481643,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,45.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481644,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,60.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481645,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,342.13603,[M-H]-,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481646,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481647,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481648,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,30.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481649,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,60.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481650,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,15.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481651,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481652,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,60.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481653,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1,344.15059,[M+H]+,20.0,val,CCc1ccc(-c2cc(C(=O)Nn3cnnc3)c3ccccc3n2)cc1
481654,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,20.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481655,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,20.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481656,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,45.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481657,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,60.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481658,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,20.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481659,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,60.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481660,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,20.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481661,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1,344.15059,[M+H]+,45.0,val,c1coc(-c2ccnc3nc(CCCc4c[nH]c5ccccc45)nn23)c1
481662,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,20.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481663,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,20.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481664,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,45.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481665,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,60.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481666,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,20.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481667,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,60.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481668,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1,344.15059,[M+H]+,20.0,val,Cc1cncc(C(=O)Nc2cccc(-c3cn4cccc(C)c4n3)c2)n1
481669,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481670,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481671,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,60.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481672,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,30.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481673,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481674,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,60.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481675,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,30.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481676,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12,344.15059,[M+H]+,20.0,val,Cc1cc(-c2ccccc2)nc2cc(C(=O)NCc3cccnc3)nn12
481677,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,20.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481678,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,20.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481679,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,60.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481680,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,30.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481681,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,20.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481682,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,60.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481683,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,30.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481684,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1,344.15059,[M+H]+,20.0,val,O=C(c1nc2ncccn2n1)N(Cc1ccccc1)Cc1ccccc1
481685,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481686,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481687,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,60.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481688,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481689,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,60.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481690,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1,344.15059,[M+H]+,20.0,val,Cc1ccc2c(=O)nc(Nc3nc(C)cc(-c4ccccc4)n3)[nH]c2c1
481691,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,20.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481692,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,20.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481693,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,60.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481694,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,20.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481695,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,20.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481696,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2,334.09072,[M-H]-,60.0,val,Cc1ccccc1S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
481697,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,20.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481698,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,20.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481699,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,60.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481700,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,30.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481701,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,20.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481702,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,60.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481703,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,30.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481704,C#CCOc1c(OC)cc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1,350.1034,[M-H]-,20.0,val,C#CCOc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)O)cc1OC
481705,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,20.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481706,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,20.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481707,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,60.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481708,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,20.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481709,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,45.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481710,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,60.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481711,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,20.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481712,COc1c(OC)c2c(cc1)cc1-c3cc4c(cc3CCn1c2=O)OCO4,352.11795,[M+H]+,45.0,val,COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCO2
481713,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12,352.11795,[M+H]+,20.0,val,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12
481714,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12,352.11795,[M+H]+,20.0,val,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12
481715,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12,352.11795,[M+H]+,60.0,val,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12
481716,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12,352.11795,[M+H]+,30.0,val,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12
481717,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12,352.11795,[M+H]+,20.0,val,CCOC(=O)c1c(-c2ccc(OC)cc2)oc2ccc(OCC#N)cc12
481718,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,414.03464,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481719,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,414.03464,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481720,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,414.03464,[M-H]-,60.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481721,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,414.03464,[M-H]-,30.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481722,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,414.03464,[M-H]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481723,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,460.04012,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481724,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,460.04012,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481725,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,460.04012,[M+FA]-,60.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481726,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,460.04012,[M+FA]-,15.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481727,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,460.04012,[M+FA]-,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481728,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,398.03864,[M+H-H2O]+,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481729,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,398.03864,[M+H-H2O]+,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481730,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,398.03864,[M+H-H2O]+,60.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481731,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,398.03864,[M+H-H2O]+,30.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481732,COc1cc(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c(Br)cc1,398.03864,[M+H-H2O]+,20.0,val,COc1ccc(Br)c(C(=O)NCC(O)c2ccc(-c3ccco3)cc2)c1
481733,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,444.14013,[M-H]-,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481734,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,444.14013,[M-H]-,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481735,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,444.14013,[M-H]-,60.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481736,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,444.14013,[M-H]-,15.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481737,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,444.14013,[M-H]-,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481738,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481739,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481740,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,60.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481741,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,15.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481742,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481743,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,45.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481744,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,60.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481745,CNCc1cc(Oc2cc3c(cc2)n(C(=O)Nc2nn(C)c(C(F)(F)F)c2)cc3)ncn1,446.15468,[M+H]+,20.0,val,CNCc1cc(Oc2ccc3c(ccn3C(=O)Nc3cc(C(F)(F)F)n(C)n3)c2)ncn1
481746,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481747,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481748,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,366.12594,[M-H]-,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481749,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,366.12594,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481750,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481751,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481752,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481753,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481754,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481755,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481756,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481757,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481758,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481759,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,402.10262,[M+Cl]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481760,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,402.10262,[M+Cl]-,30.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481761,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481762,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481763,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,366.12594,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481764,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,366.12594,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481765,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481766,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481767,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,368.1405,[M+H]+,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481768,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,368.1405,[M+H]+,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481769,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc(F)ccc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(F)c2)no1
481770,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481771,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481772,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,368.1405,[M+H]+,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481773,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,368.1405,[M+H]+,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481774,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2F)no1
481775,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481776,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481777,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,368.1405,[M+H]+,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481778,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,368.1405,[M+H]+,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481779,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1,368.1405,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)no1
481780,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1,368.1405,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1
481781,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1,368.1405,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1
481782,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1,368.1405,[M+H]+,60.0,val,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1
481783,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1,368.1405,[M+H]+,30.0,val,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1
481784,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1,368.1405,[M+H]+,20.0,val,O=C(c1cc(-c2ccccc2)on1)N1CCC(COc2ccc(F)cn2)C1
481785,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481786,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481787,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,60.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481788,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481789,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,45.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481790,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,60.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481791,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481792,COC(=O)c1cc2c(cc1)c(=O)n(-c1cc(F)c(C)cc1)c(N1CCSC1)n2,400.11257,[M+H]+,45.0,val,COC(=O)c1ccc2c(=O)n(-c3ccc(C)c(F)c3)c(N3CCSC3)nc2c1
481793,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,20.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481794,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,20.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481795,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,60.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481796,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,30.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481797,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,20.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481798,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,60.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481799,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,30.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481800,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2,384.13541,[M+H]+,20.0,val,CCOc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc2c(c1)OCCO2
481801,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481802,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481803,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,60.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481804,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481805,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,45.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481806,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,60.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481807,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481808,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,317.12955,[M-H]-,45.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481809,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,363.13503,[M+FA]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481810,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,363.13503,[M+FA]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481811,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,363.13503,[M+FA]-,60.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481812,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,363.13503,[M+FA]-,15.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481813,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,363.13503,[M+FA]-,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481814,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,319.1441,[M+H]+,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481815,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,319.1441,[M+H]+,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481816,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,319.1441,[M+H]+,60.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481817,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,319.1441,[M+H]+,30.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481818,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12,319.1441,[M+H]+,20.0,val,CC1Cc2ccccc2C1NC(=O)c1c[nH]c(=O)c2ccccc12
481819,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12,319.1441,[M+H]+,20.0,val,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12
481820,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12,319.1441,[M+H]+,20.0,val,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12
481821,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12,319.1441,[M+H]+,60.0,val,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12
481822,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12,319.1441,[M+H]+,30.0,val,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12
481823,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12,319.1441,[M+H]+,20.0,val,COc1c(C(=O)N2CC=C(c3ccccc3)C2)[nH]c2ccccc12
481824,CCN(CC)c1cc2c(cc1)nc1-c(cc(=O)c3ccccc13)o2,319.1441,[M+H]+,20.0,val,CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1
481825,CCN(CC)c1cc2c(cc1)nc1-c(cc(=O)c3ccccc13)o2,319.1441,[M+H]+,20.0,val,CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1
481826,CCN(CC)c1cc2c(cc1)nc1-c(cc(=O)c3ccccc13)o2,319.1441,[M+H]+,60.0,val,CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1
481827,CCN(CC)c1cc2c(cc1)nc1-c(cc(=O)c3ccccc13)o2,319.1441,[M+H]+,20.0,val,CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1
481828,CCN(CC)c1cc2c(cc1)nc1-c(cc(=O)c3ccccc13)o2,319.1441,[M+H]+,60.0,val,CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1
481829,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,363.13503,[M+FA]-,60.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481830,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,363.13503,[M+FA]-,15.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481831,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,363.13503,[M+FA]-,20.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481832,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,317.12955,[M-H]-,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481833,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,317.12955,[M-H]-,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481834,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,317.12955,[M-H]-,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481835,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,317.12955,[M-H]-,60.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481836,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,317.12955,[M-H]-,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481837,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,317.12955,[M-H]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481838,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,317.12955,[M-H]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481839,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,317.12955,[M-H]-,60.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481840,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,317.12955,[M-H]-,30.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481841,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,317.12955,[M-H]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481842,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,363.13503,[M+FA]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481843,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,363.13503,[M+FA]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481844,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,363.13503,[M+FA]-,60.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481845,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,363.13503,[M+FA]-,15.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481846,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,363.13503,[M+FA]-,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481847,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481848,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481849,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,45.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481850,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,60.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481851,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481852,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481853,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,45.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481854,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,317.12955,[M-H]-,60.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481855,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,317.12955,[M-H]-,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481856,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,317.12955,[M-H]-,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481857,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,317.12955,[M-H]-,45.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481858,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,317.12955,[M-H]-,60.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481859,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,317.12955,[M-H]-,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481860,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,317.12955,[M-H]-,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481861,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,317.12955,[M-H]-,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481862,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,317.12955,[M-H]-,60.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481863,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,317.12955,[M-H]-,15.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481864,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,317.12955,[M-H]-,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481865,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481866,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481867,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,45.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481868,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,60.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481869,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481870,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,60.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481871,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,45.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481872,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(Oc2ccc(NC(=O)c3ccncc3)cc2)cc1C
481873,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,20.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481874,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,20.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481875,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,60.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481876,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,30.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481877,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,20.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481878,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,60.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481879,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,30.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481880,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21,319.1441,[M+H]+,20.0,val,OC(COc1ccccn1)Cn1c2ccccc2c2ccccc21
481881,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481882,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481883,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481884,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481885,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481886,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481887,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481888,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCc4ccccc4C3)no2)cc1
481889,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481890,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481891,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,45.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481892,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,60.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481893,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481894,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,20.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481895,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,60.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481896,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1,319.1441,[M+H]+,45.0,val,COc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cn1
481897,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481898,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481899,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,15.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481900,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,60.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481901,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481902,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481903,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481904,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,319.1441,[M+H]+,60.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481905,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481906,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481907,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,60.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481908,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481909,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481910,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,60.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481911,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,30.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481912,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1,336.17065,[M+NH4]+,20.0,val,COc1ccc(C(=O)NN(c2ccccc2)c2ccccc2)cc1
481913,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1,319.1441,[M+H]+,20.0,val,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1
481914,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1,319.1441,[M+H]+,20.0,val,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1
481915,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1,319.1441,[M+H]+,60.0,val,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1
481916,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1,319.1441,[M+H]+,30.0,val,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1
481917,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1,319.1441,[M+H]+,20.0,val,O=C(Cc1cc(-c2ccccc2)on1)N1CCc2ccccc2C1
481918,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,20.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481919,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,20.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481920,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,60.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481921,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,30.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481922,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,20.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481923,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,30.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481924,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,60.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481925,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12,319.1441,[M+H]+,20.0,val,COc1cc(C)ccc1C(=O)N/N=C/c1cccc2ccccc12
481926,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481927,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481928,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,60.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481929,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,30.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481930,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481931,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,30.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481932,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,60.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481933,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1,319.1441,[M+H]+,20.0,val,O=C(Nc1onc2c1CCCC2)c1ccc(-c2ccccc2)cc1
481934,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481935,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481936,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481937,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481938,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481939,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481940,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481941,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1,319.1441,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCCc4ccccc43)no2)cc1
481942,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481943,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481944,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481945,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481946,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,15.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481947,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481948,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481949,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C,319.1441,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(Oc3ccccn3)c2)cc1C
481950,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481951,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481952,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,45.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481953,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,60.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481954,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481955,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,60.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481956,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481957,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1,319.1441,[M+H]+,45.0,val,COc1cccc(-c2cc(C(=O)NC3CC3)c3ccccc3n2)c1
481958,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481959,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481960,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,60.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481961,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,30.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481962,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481963,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,30.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481964,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,60.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481965,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1,319.1441,[M+H]+,20.0,val,COc1cccc(C(=O)N(Cc2ccccc2)c2ccccn2)c1
481966,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,441.06967,[M-H]-,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481967,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,441.06967,[M-H]-,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481968,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,441.06967,[M-H]-,60.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481969,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,441.06967,[M-H]-,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481970,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,441.06967,[M-H]-,45.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481971,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,443.08422,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481972,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,443.08422,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481973,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,443.08422,[M+H]+,60.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481974,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,443.08422,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481975,COc1ccc(-c2cc3nc4c(CCN(S(=O)(=O)c5cccs5)C4)c(=O)n3[nH]2)cc1,443.08422,[M+H]+,45.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CCN(S(=O)(=O)c2cccs2)C4)cc1
481976,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,441.06967,[M-H]-,20.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481977,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,441.06967,[M-H]-,45.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481978,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,441.06967,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481979,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,441.06967,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481980,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,441.06967,[M-H]-,60.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481981,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,441.06967,[M-H]-,30.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481982,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,441.06967,[M-H]-,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481983,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481984,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481985,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,60.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481986,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,30.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481987,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481988,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,60.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481989,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,30.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481990,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1,443.08422,[M+H]+,20.0,val,CCOC(=O)Cc1csc(NC(=O)c2sc3nc4ccc(OC)cc4cc3c2N)n1
481991,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,20.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481992,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,20.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481993,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,45.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481994,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,60.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481995,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,20.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481996,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,60.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481997,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,45.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481998,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1,443.08422,[M+H]+,20.0,val,Cc1nn2c(CNS(=O)(=O)c3ccc4c(c3)OCCO4)c(-c3ccccc3)nc2s1
481999,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,453.0809,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482000,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,453.0809,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482001,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,453.0809,[M-H]-,60.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482002,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,453.0809,[M-H]-,15.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482003,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,453.0809,[M-H]-,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482004,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,455.09546,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482005,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,455.09546,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482006,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,455.09546,[M+H]+,60.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482007,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,455.09546,[M+H]+,30.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482008,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1,455.09546,[M+H]+,20.0,val,COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1
482009,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1,369.09798,[M-H]-,20.0,val,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
482010,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1,369.09798,[M-H]-,20.0,val,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
482011,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1,369.09798,[M-H]-,60.0,val,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
482012,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1,369.09798,[M-H]-,15.0,val,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
482013,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1,369.09798,[M-H]-,20.0,val,COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
482014,C/C=C(/C)c1c(C(=O)O)c(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1,369.09798,[M-H]-,20.0,val,C/C=C(/C)c1c2c(c(C)c(O)c1C(=O)O)OC(=O)c1c(C)cc(O)cc1O2
482015,C/C=C(/C)c1c(C(=O)O)c(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1,369.09798,[M-H]-,20.0,val,C/C=C(/C)c1c2c(c(C)c(O)c1C(=O)O)OC(=O)c1c(C)cc(O)cc1O2
482016,C/C=C(/C)c1c(C(=O)O)c(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1,369.09798,[M-H]-,60.0,val,C/C=C(/C)c1c2c(c(C)c(O)c1C(=O)O)OC(=O)c1c(C)cc(O)cc1O2
482017,C/C=C(/C)c1c(C(=O)O)c(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1,369.09798,[M-H]-,30.0,val,C/C=C(/C)c1c2c(c(C)c(O)c1C(=O)O)OC(=O)c1c(C)cc(O)cc1O2
482018,C/C=C(/C)c1c(C(=O)O)c(O)c(C)c2c1Oc1c(C(=O)O2)c(C)cc(O)c1,369.09798,[M-H]-,20.0,val,C/C=C(/C)c1c2c(c(C)c(O)c1C(=O)O)OC(=O)c1c(C)cc(O)cc1O2
482019,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482020,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482021,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,30.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482022,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,60.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482023,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,15.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482024,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482025,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,60.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482026,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC,387.11061,[M+H]+,20.0,val,COc1ccc(CCNC(=O)c2cc(-c3ccccc3Cl)on2)cc1OC
482027,COCCN(C)c1ncc(NC(=O)c2c(C(F)(F)F)oc(-c3ccccc3)n2)cc1,421.1482,[M+H]+,45.0,val,COCCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1
482028,COCCN(C)c1ncc(NC(=O)c2c(C(F)(F)F)oc(-c3ccccc3)n2)cc1,421.1482,[M+H]+,45.0,val,COCCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1
482029,COCCN(C)c1ncc(NC(=O)c2c(C(F)(F)F)oc(-c3ccccc3)n2)cc1,421.1482,[M+H]+,20.0,val,COCCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1
482030,COCCN(C)c1ncc(NC(=O)c2c(C(F)(F)F)oc(-c3ccccc3)n2)cc1,421.1482,[M+H]+,60.0,val,COCCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1
482031,COCCN(C)c1ncc(NC(=O)c2c(C(F)(F)F)oc(-c3ccccc3)n2)cc1,421.1482,[M+H]+,45.0,val,COCCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1
482032,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,20.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482033,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,20.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482034,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,45.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482035,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,60.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482036,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,20.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482037,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,45.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482038,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,20.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482039,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21,335.16665,[M+H]+,60.0,val,CCCCCn1c(-c2ccc(F)cc2)nc2nc3ccccc3nc21
482040,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482041,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482042,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,60.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482043,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482044,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,45.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482045,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,60.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482046,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482047,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,393.14808,[M-H]-,45.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482048,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,429.12475,[M+Cl]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482049,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,429.12475,[M+Cl]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482050,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,429.12475,[M+Cl]-,60.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482051,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,429.12475,[M+Cl]-,15.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482052,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,429.12475,[M+Cl]-,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482053,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482054,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482055,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,60.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482056,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,15.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482057,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482058,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,60.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482059,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,15.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482060,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4nc5c(cc4)cc(F)cc5)[C@@H]3C2)nc1,395.16263,[M+H]+,20.0,val,O=C(NO)c1cnc(N2C[C@@H]3C(NCc4ccc5cc(F)ccc5n4)[C@@H]3C2)nc1
482061,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,20.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482062,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,20.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482063,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,60.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482064,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,30.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482065,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,20.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482066,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,60.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482067,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,30.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482068,CCCc1noc(-c2cn3c(CC(=O)Nc4c(F)cc(C)cc4)nnc3cc2)n1,395.16263,[M+H]+,20.0,val,CCCc1noc(-c2ccc3nnc(CC(=O)Nc4ccc(C)cc4F)n3c2)n1
482069,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482070,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482071,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,30.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482072,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,60.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482073,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,15.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482074,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482075,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,60.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482076,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1,395.16263,[M+H]+,20.0,val,O=C(Cn1ncccc1=O)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1
482077,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,451.16479,[M+FA]-,20.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482078,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,451.16479,[M+FA]-,15.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482079,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,451.16479,[M+FA]-,20.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482080,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,407.17386,[M+H]+,20.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482081,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,407.17386,[M+H]+,20.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482082,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,407.17386,[M+H]+,60.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482083,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,407.17386,[M+H]+,15.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482084,CN(C(=O)c1nn(C)cc1)C1CN(c2nn3c(-c4cc(F)ccc4)nnc3cc2)C1,407.17386,[M+H]+,20.0,val,CN(C(=O)c1ccn(C)n1)C1CN(c2ccc3nnc(-c4cccc(F)c4)n3n2)C1
482085,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482086,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482087,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482088,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482089,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,45.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482090,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482091,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482092,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,412.07951,[M-H]-,45.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482093,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482094,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482095,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482096,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,30.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482097,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482098,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482099,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,30.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482100,CC(C)(C)S(=O)(=O)c1cc2c(Nc3cc4c(cc3)scn4)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482101,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482102,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482103,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,45.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482104,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482105,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482106,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,45.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482107,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482108,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,412.07951,[M-H]-,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482109,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482110,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482111,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482112,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,30.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482113,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482114,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,60.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482115,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,30.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482116,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O,414.09406,[M+H]+,20.0,val,CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ccnc2cc1O
482117,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482118,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482119,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,60.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482120,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482121,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,45.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482122,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,60.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482123,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482124,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,364.13028,[M-H]-,45.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482125,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,410.13576,[M+FA]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482126,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,410.13576,[M+FA]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482127,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,410.13576,[M+FA]-,60.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482128,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,410.13576,[M+FA]-,15.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482129,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,410.13576,[M+FA]-,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482130,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,366.14483,[M+H]+,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482131,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,366.14483,[M+H]+,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482132,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,366.14483,[M+H]+,60.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482133,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,366.14483,[M+H]+,30.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482134,O=C(NC(CO)C1CC1)c1cc2c(cc1)c(=O)n(-c1ccccc1)c(=O)[nH]2,366.14483,[M+H]+,20.0,val,O=C(NC(CO)C1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1
482135,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,20.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482136,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,20.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482137,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,60.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482138,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,30.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482139,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,20.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482140,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,60.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482141,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,30.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482142,COc1cc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)nc(C(N)=O)c1,366.14483,[M+H]+,20.0,val,COc1cc(C(N)=O)nc(-c2cccc(C#C[C@]3(O)CCN(C)C3=O)c2)c1
482143,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1,366.14483,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1
482144,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1,366.14483,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1
482145,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1,366.14483,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1
482146,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1,366.14483,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1
482147,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1,366.14483,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)no2)cc1
482148,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,20.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482149,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,20.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482150,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,60.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482151,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,15.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482152,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,20.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482153,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,60.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482154,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,20.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482155,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1,366.14483,[M+H]+,15.0,val,CCOc1ccccc1-c1noc(CN2C(=O)C(C)Oc3ccccc32)n1
482156,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,438.12415,[M+FA]-,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482157,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,438.12415,[M+FA]-,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482158,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,438.12415,[M+FA]-,60.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482159,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,438.12415,[M+FA]-,15.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482160,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,438.12415,[M+FA]-,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482161,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,394.13322,[M+H]+,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482162,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,394.13322,[M+H]+,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482163,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,394.13322,[M+H]+,60.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482164,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,394.13322,[M+H]+,15.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482165,O=C(CC(c1cscc1)n1cccc1)NCCc1nc(-c2ccccn2)no1,394.13322,[M+H]+,20.0,val,O=C(CC(c1ccsc1)n1cccc1)NCCc1nc(-c2ccccn2)no1
482166,Oc1c(O)cc2c(c1)CCNC2Cc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,Oc1cc2c(cc1O)C(Cc1cccc3ccccc13)NCC2
482167,Oc1c(O)cc2c(c1)CCNC2Cc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,Oc1cc2c(cc1O)C(Cc1cccc3ccccc13)NCC2
482168,Oc1c(O)cc2c(c1)CCNC2Cc1cccc2ccccc12,306.14885,[M+H]+,60.0,val,Oc1cc2c(cc1O)C(Cc1cccc3ccccc13)NCC2
482169,Oc1c(O)cc2c(c1)CCNC2Cc1cccc2ccccc12,306.14885,[M+H]+,30.0,val,Oc1cc2c(cc1O)C(Cc1cccc3ccccc13)NCC2
482170,Oc1c(O)cc2c(c1)CCNC2Cc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,Oc1cc2c(cc1O)C(Cc1cccc3ccccc13)NCC2
482171,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482172,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482173,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,60.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482174,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,30.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482175,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482176,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482177,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,30.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482178,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,304.1343,[M-H]-,60.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482179,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,350.13978,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482180,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,350.13978,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482181,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,350.13978,[M+FA]-,60.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482182,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,350.13978,[M+FA]-,15.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482183,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,350.13978,[M+FA]-,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482184,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,304.1343,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482185,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,304.1343,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482186,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,304.1343,[M-H]-,45.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482187,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,304.1343,[M-H]-,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482188,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,304.1343,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482189,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1
482190,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1
482191,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1
482192,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1,306.14885,[M+H]+,30.0,val,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1
482193,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(N=Cc2c(OC)ccc3ccccc23)cc1
482194,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482195,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482196,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,60.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482197,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,30.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482198,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482199,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,30.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482200,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,20.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482201,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12,306.14885,[M+H]+,60.0,val,CCC(Oc1ccccc1)C(=O)Nc1cccc2ccccc12
482202,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,20.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482203,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,20.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482204,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,60.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482205,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,30.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482206,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,20.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482207,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,30.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482208,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,60.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482209,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1,306.14885,[M+H]+,20.0,val,O=C(NCCc1ccoc1)C(c1ccccc1)c1ccccc1
482210,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1
482211,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1
482212,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1
482213,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,30.0,val,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1
482214,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,CCOc1ccc(NC(=O)Cc2cccc3ccccc23)cc1
482215,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482216,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482217,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482218,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482219,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482220,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482221,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482222,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1,306.14885,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C2=Cc3ccc(C)cc3OC=C2)c1
482223,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1
482224,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1
482225,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1
482226,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1,306.14885,[M+H]+,15.0,val,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1
482227,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(CNC(=O)COc2cccc3ccccc23)cc1
482228,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1,306.14885,[M+H]+,20.0,val,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
482229,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1,306.14885,[M+H]+,20.0,val,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
482230,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1,306.14885,[M+H]+,45.0,val,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
482231,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1,306.14885,[M+H]+,60.0,val,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
482232,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1,306.14885,[M+H]+,20.0,val,CC1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
482233,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482234,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482235,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,45.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482236,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,60.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482237,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482238,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,60.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482239,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,45.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482240,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,306.14885,[M+H]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482241,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482242,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482243,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,45.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482244,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,60.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482245,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482246,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,20.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482247,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,45.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482248,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1,328.1308,[M+Na]+,60.0,val,Cc1ccc2cccc(OCC(=O)c3ccc(C)c(C)c3)c2n1
482249,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,288.13829,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482250,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,288.13829,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482251,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,288.13829,[M+H-H2O]+,60.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482252,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,288.13829,[M+H-H2O]+,15.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482253,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,288.13829,[M+H-H2O]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482254,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,306.14885,[M+H]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482255,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,306.14885,[M+H]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482256,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,306.14885,[M+H]+,15.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482257,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,306.14885,[M+H]+,60.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482258,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12,306.14885,[M+H]+,20.0,val,O=C(NCCC(O)c1ccccc1)c1cccc2ccccc12
482259,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482260,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482261,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,60.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482262,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,30.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482263,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482264,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,60.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482265,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,30.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482266,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12,306.14885,[M+H]+,20.0,val,COc1c(C(=O)Nc2ccc(C)cc2C)ccc2ccccc12
482267,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482268,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482269,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,60.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482270,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,30.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482271,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482272,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482273,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,30.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482274,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,60.0,val,CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
482275,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1
482276,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1
482277,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1
482278,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,30.0,val,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1
482279,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,COc1ccc(CNC(=O)Cc2cccc3ccccc23)cc1
482280,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482281,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482282,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,60.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482283,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,15.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482284,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482285,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,60.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482286,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,20.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482287,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1,306.14885,[M+H]+,15.0,val,CC(NC(=O)COc1cccc2ccccc12)c1ccccc1
482288,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,306.14885,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482289,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,306.14885,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482290,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,306.14885,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482291,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,306.14885,[M+H]+,15.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482292,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,306.14885,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482293,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482294,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482295,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482296,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482297,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482298,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482299,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482300,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1,323.1754,[M+NH4]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
482301,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482302,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482303,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482304,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,30.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482305,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482306,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,20.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482307,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,30.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482308,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1,306.14885,[M+H]+,60.0,val,Cc1ccc(OC(C)C(=O)Nc2cccc3ccccc23)cc1
482309,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482310,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482311,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,30.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482312,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,60.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482313,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482314,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,45.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482315,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,20.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482316,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,30.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482317,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1,306.14885,[M+H]+,60.0,val,CCN(C(=O)COc1ccc2ccccc2c1)c1ccccc1
482318,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482319,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482320,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,60.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482321,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,30.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482322,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482323,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482324,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,30.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482325,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,373.11246,[M-H]-,60.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482326,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482327,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482328,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,60.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482329,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,15.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482330,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482331,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,15.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482332,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,20.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482333,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1,419.11794,[M+FA]-,60.0,val,CC(=O)Nc1ccc(C2(C(=O)NCc3ccc(F)c(Cl)c3)CCC2)cc1
482334,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482335,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482336,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,45.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482337,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,60.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482338,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482339,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,20.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482340,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,45.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482341,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21,375.12701,[M+H]+,60.0,val,CC(C)(C)C(=O)N1CCc2ccc(NC(=O)c3ccc(F)cc3Cl)cc21
482342,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cc(Cl)ccc2)cc1,370.13168,[M+H]+,20.0,val,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cccc(Cl)c2)cc1
482343,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cc(Cl)ccc2)cc1,370.13168,[M+H]+,20.0,val,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cccc(Cl)c2)cc1
482344,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cc(Cl)ccc2)cc1,370.13168,[M+H]+,60.0,val,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cccc(Cl)c2)cc1
482345,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cc(Cl)ccc2)cc1,370.13168,[M+H]+,20.0,val,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cccc(Cl)c2)cc1
482346,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cc(Cl)ccc2)cc1,370.13168,[M+H]+,45.0,val,O=C1NCCN1c1ccc(C(=O)N2CCCC2c2cccc(Cl)c2)cc1
482347,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1,370.13168,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1
482348,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1,370.13168,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1
482349,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1,370.13168,[M+H]+,45.0,val,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1
482350,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1,370.13168,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1
482351,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1,370.13168,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCN(c2cccc(Cl)c2)CC1
482352,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,20.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482353,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,20.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482354,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,45.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482355,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,60.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482356,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,20.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482357,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,60.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482358,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,45.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482359,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O,370.13168,[M+H]+,20.0,val,CCOc1ccccc1-n1ccnc(NCCc2ccc(Cl)cc2)c1=O
482360,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,20.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482361,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,20.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482362,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,45.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482363,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,60.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482364,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,20.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482365,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,45.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482366,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,60.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482367,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1,446.10481,[M+H]+,20.0,val,O=S(=O)(c1cccc(Cl)c1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1
482368,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482369,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482370,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482371,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,30.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482372,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482373,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482374,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,30.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482375,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,373.13692,[M-H]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482376,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,409.1136,[M+Cl]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482377,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,409.1136,[M+Cl]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482378,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,409.1136,[M+Cl]-,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482379,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,409.1136,[M+Cl]-,15.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482380,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,409.1136,[M+Cl]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482381,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,419.1424,[M+FA]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482382,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,419.1424,[M+FA]-,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482383,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,419.1424,[M+FA]-,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482384,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482385,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482386,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482387,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,30.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482388,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482389,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,60.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482390,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,30.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482391,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,375.15148,[M+H]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482392,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,397.13342,[M+Na]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482393,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1,397.13342,[M+Na]+,20.0,val,O=C(NOCc1ccc(F)cc1)C1CCCN(C(=O)c2ccc(F)cc2)C1
482394,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,20.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482395,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,20.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482396,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,45.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482397,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,60.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482398,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,20.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482399,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,60.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482400,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,45.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482401,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21,376.16312,[M+H]+,20.0,val,O=C(Cc1cccc(C(F)(F)F)c1)N1CCC2CN(c3ccccn3)CC21
482402,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,395.13882,[M-H]-,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482403,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,395.13882,[M-H]-,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482404,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,395.13882,[M-H]-,60.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482405,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,395.13882,[M-H]-,30.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482406,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,395.13882,[M-H]-,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482407,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482408,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482409,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,60.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482410,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,15.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482411,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482412,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,60.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482413,CC(C)(C[C@@](O)(Cc1cc2c(cncc2)[nH]1)C(F)(F)F)c1c(O)ccc(F)c1,397.15337,[M+H]+,20.0,val,CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O
482414,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482415,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482416,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,60.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482417,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,30.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482418,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482419,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,30.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482420,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482421,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,415.07917,[M-H]-,60.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482422,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482423,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482424,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,45.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482425,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,60.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482426,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482427,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,45.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482428,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,60.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482429,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1,417.09373,[M+H]+,20.0,val,COc1ccc(-c2nc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)sc2C)cc1
482430,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,371.17382,[M-H]-,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482431,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,371.17382,[M-H]-,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482432,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,371.17382,[M-H]-,60.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482433,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,371.17382,[M-H]-,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482434,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,371.17382,[M-H]-,60.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482435,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482436,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482437,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,60.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482438,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482439,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,60.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482440,Cc1ccc(Nc2c(Nc3ccc(C)cc3)nc3c(N)nnc(N)c3n2)cc1,373.18837,[M+H]+,20.0,val,Cc1ccc(Nc2nc3c(N)nnc(N)c3nc2Nc2ccc(C)cc2)cc1
482441,CC(C)(O)CCc1c2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)cc1O,355.11762,[M+H-H2O]+,20.0,val,CC(C)(O)CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
482442,CC(C)(O)CCc1c2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)cc1O,355.11762,[M+H-H2O]+,20.0,val,CC(C)(O)CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
482443,CC(C)(O)CCc1c2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)cc1O,355.11762,[M+H-H2O]+,60.0,val,CC(C)(O)CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
482444,CC(C)(O)CCc1c2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)cc1O,355.11762,[M+H-H2O]+,20.0,val,CC(C)(O)CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
482445,CC(C)(O)CCc1c2oc(-c3ccc(O)cc3)c(O)c(=O)c2c(O)cc1O,355.11762,[M+H-H2O]+,45.0,val,CC(C)(O)CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
482446,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482447,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482448,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482449,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482450,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482451,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482452,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482453,COc1c(OC)cc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1OC
482454,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,372.12035,[M]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482455,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,372.12035,[M]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482456,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,372.12035,[M]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482457,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,372.12035,[M]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482458,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,372.12035,[M]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482459,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482460,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482461,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482462,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482463,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482464,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482465,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482466,COc1c(OC)cc(-c2cc(=O)c3c(o2)c(OC)c(OC)cc3OC)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)cc(OC)c(OC)c3o2)cc1OC
482467,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482468,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482469,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482470,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482471,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482472,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482473,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482474,COc1ccc(-c2cc(=O)c3c(o2)c(OC)c(OC)c(OC)c3OC)cc1,373.12818,[M+H]+,45.0,val,COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
482475,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,371.11363,[M-H]-,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482476,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,371.11363,[M-H]-,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482477,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,371.11363,[M-H]-,60.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482478,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,371.11363,[M-H]-,30.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482479,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,371.11363,[M-H]-,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482480,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,371.11363,[M-H]-,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482481,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,371.11363,[M-H]-,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482482,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,371.11363,[M-H]-,60.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482483,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,371.11363,[M-H]-,30.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482484,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,371.11363,[M-H]-,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482485,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,373.12818,[M+H]+,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482486,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,373.12818,[M+H]+,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482487,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,373.12818,[M+H]+,60.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482488,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,373.12818,[M+H]+,30.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482489,CCCCCC(O)c1c(O)cc2C(=O)c3c(C(=O)c2c1O)c(O)cc(O)c3,373.12818,[M+H]+,20.0,val,CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
482490,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,373.12818,[M+H]+,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482491,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,373.12818,[M+H]+,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482492,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,373.12818,[M+H]+,60.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482493,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,373.12818,[M+H]+,30.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482494,COc1c(O)ccc(C(=O)C2(C)OC2(C)C(=O)c2cc(OC)c(O)cc2)c1,373.12818,[M+H]+,20.0,val,COc1cc(C(=O)C2(C)OC2(C)C(=O)c2ccc(O)c(OC)c2)ccc1O
482495,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482496,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482497,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,45.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482498,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,60.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482499,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482500,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,60.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482501,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,45.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482502,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)c(OC)c(-c3ccc(OC)c(OC)c3)oc2c1
482503,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,355.11762,[M+H-H2O]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482504,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,355.11762,[M+H-H2O]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482505,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,355.11762,[M+H-H2O]+,45.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482506,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,355.11762,[M+H-H2O]+,60.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482507,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482508,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482509,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,45.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482510,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,60.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482511,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482512,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,60.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482513,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,45.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482514,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1,373.12818,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)cc(-c3cc(OC)c(OC)c(OC)c3)oc2c1
482515,CS(=O)(=O)N1CCN(C(=O)C2(c3cc(Br)ccc3)CC2)Cc2ccccc21,449.0529,[M+H]+,20.0,val,CS(=O)(=O)N1CCN(C(=O)C2(c3cccc(Br)c3)CC2)Cc2ccccc21
482516,CS(=O)(=O)N1CCN(C(=O)C2(c3cc(Br)ccc3)CC2)Cc2ccccc21,449.0529,[M+H]+,20.0,val,CS(=O)(=O)N1CCN(C(=O)C2(c3cccc(Br)c3)CC2)Cc2ccccc21
482517,CS(=O)(=O)N1CCN(C(=O)C2(c3cc(Br)ccc3)CC2)Cc2ccccc21,449.0529,[M+H]+,60.0,val,CS(=O)(=O)N1CCN(C(=O)C2(c3cccc(Br)c3)CC2)Cc2ccccc21
482518,CS(=O)(=O)N1CCN(C(=O)C2(c3cc(Br)ccc3)CC2)Cc2ccccc21,449.0529,[M+H]+,30.0,val,CS(=O)(=O)N1CCN(C(=O)C2(c3cccc(Br)c3)CC2)Cc2ccccc21
482519,CS(=O)(=O)N1CCN(C(=O)C2(c3cc(Br)ccc3)CC2)Cc2ccccc21,449.0529,[M+H]+,20.0,val,CS(=O)(=O)N1CCN(C(=O)C2(c3cccc(Br)c3)CC2)Cc2ccccc21
482520,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,447.03835,[M-H]-,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482521,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,447.03835,[M-H]-,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482522,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,447.03835,[M-H]-,45.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482523,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,447.03835,[M-H]-,60.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482524,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,447.03835,[M-H]-,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482525,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,449.0529,[M+H]+,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482526,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,449.0529,[M+H]+,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482527,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,449.0529,[M+H]+,30.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482528,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,449.0529,[M+H]+,60.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482529,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1,449.0529,[M+H]+,20.0,val,O=C(NC(=S)N1CCOCC1)c1ccc(OCCc2ccccc2)c(Br)c1
482530,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482531,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482532,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,60.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482533,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,30.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482534,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482535,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,60.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482536,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,30.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482537,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,392.08257,[M-H]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482538,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,428.05925,[M+Cl]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482539,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,428.05925,[M+Cl]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482540,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,428.05925,[M+Cl]-,60.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482541,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,428.05925,[M+Cl]-,15.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482542,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,428.05925,[M+Cl]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482543,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,438.08805,[M+FA]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482544,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,438.08805,[M+FA]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482545,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,438.08805,[M+FA]-,60.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482546,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,438.08805,[M+FA]-,15.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482547,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1,438.08805,[M+FA]-,20.0,val,O=C(NCC1(c2ccccc2)CCOCC1)C(O)c1cc(Cl)cc(Cl)c1
482548,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482549,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482550,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,60.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482551,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,15.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482552,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482553,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,60.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482554,Cc1c(CN2CCOCC2)cc(C)c(OC(=O)c2c(Cl)cc(Cl)cc2)c1,394.09713,[M+H]+,20.0,val,Cc1cc(OC(=O)c2ccc(Cl)cc2Cl)c(C)cc1CN1CCOCC1
482555,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,395.13926,[M-H]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482556,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,395.13926,[M-H]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482557,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,395.13926,[M-H]-,60.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482558,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,395.13926,[M-H]-,15.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482559,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,395.13926,[M-H]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482560,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,431.11594,[M+Cl]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482561,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,431.11594,[M+Cl]-,15.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482562,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482563,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482564,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,60.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482565,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,15.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482566,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482567,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,60.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482568,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,15.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482569,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,441.14474,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482570,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,397.15381,[M+H]+,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482571,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,397.15381,[M+H]+,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482572,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,397.15381,[M+H]+,60.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482573,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,397.15381,[M+H]+,15.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482574,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1,397.15381,[M+H]+,20.0,val,O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NCc1ccc(Cl)cc1
482575,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,355.14634,[M-H]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482576,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,355.14634,[M-H]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482577,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,355.14634,[M-H]-,60.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482578,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,355.14634,[M-H]-,30.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482579,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,355.14634,[M-H]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482580,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482581,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482582,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,60.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482583,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,15.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482584,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482585,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,15.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482586,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,60.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482587,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,401.15182,[M+FA]-,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482588,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,355.14634,[M-H]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482589,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,355.14634,[M-H]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482590,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,355.14634,[M-H]-,60.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482591,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,355.14634,[M-H]-,30.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482592,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,355.14634,[M-H]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482593,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482594,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482595,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,60.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482596,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,15.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482597,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482598,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482599,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,15.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482600,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,401.15182,[M+FA]-,60.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482601,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482602,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482603,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,60.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482604,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,30.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482605,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482606,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,60.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482607,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,30.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482608,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1,357.1609,[M+H]+,20.0,val,Cc1ccc(OCC(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)cc1
482609,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482610,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482611,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,60.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482612,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,30.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482613,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482614,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,60.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482615,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,30.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482616,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,COc1ccccc1C(=O)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482617,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482618,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482619,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,60.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482620,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,30.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482621,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482622,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,20.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482623,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,60.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482624,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1,357.1609,[M+H]+,30.0,val,O=C(COc1ccccc1)NCC1CC(=O)N(Cc2ccc(F)cc2)C1
482625,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482626,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482627,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482628,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482629,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482630,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482631,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482632,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,371.14126,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482633,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,407.11794,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482634,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,407.11794,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482635,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,407.11794,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482636,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,407.11794,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482637,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,407.11794,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482638,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482639,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482640,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482641,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,15.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482642,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482643,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,15.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482644,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482645,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,417.14674,[M+FA]-,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482646,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,371.14126,[M-H]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482647,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,371.14126,[M-H]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482648,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,371.14126,[M-H]-,60.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482649,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,371.14126,[M-H]-,30.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482650,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,371.14126,[M-H]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482651,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,417.14674,[M+FA]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482652,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,417.14674,[M+FA]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482653,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,417.14674,[M+FA]-,60.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482654,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,417.14674,[M+FA]-,15.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482655,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,417.14674,[M+FA]-,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482656,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,417.14674,[M+FA]-,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482657,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,417.14674,[M+FA]-,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482658,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,417.14674,[M+FA]-,60.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482659,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,417.14674,[M+FA]-,15.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482660,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,417.14674,[M+FA]-,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482661,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,373.15581,[M+H]+,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482662,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,373.15581,[M+H]+,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482663,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,373.15581,[M+H]+,60.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482664,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,373.15581,[M+H]+,15.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482665,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1,373.15581,[M+H]+,20.0,val,COC(=O)C1CC(Oc2ccccc2F)CN1C(=O)Nc1cccc(C)c1
482666,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482667,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482668,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482669,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,30.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482670,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482671,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,30.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482672,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482673,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1,373.15581,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)NCC2CC(=O)N(c3ccc(F)cc3)C2)c1
482674,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482675,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482676,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482677,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482678,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482679,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482680,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482681,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1,373.15581,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)NCC(=O)N1CCOC(c2ccccc2)C1
482682,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,350.15102,[M-H]-,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482683,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,350.15102,[M-H]-,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482684,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,350.15102,[M-H]-,60.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482685,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,350.15102,[M-H]-,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482686,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,350.15102,[M-H]-,45.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482687,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,386.12769,[M+Cl]-,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482688,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,386.12769,[M+Cl]-,60.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482689,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,386.12769,[M+Cl]-,15.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482690,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482691,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482692,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,60.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482693,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,15.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482694,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482695,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,60.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482696,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,15.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482697,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,396.15649,[M+FA]-,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482698,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482699,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482700,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,60.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482701,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482702,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,60.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482703,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,350.15102,[M-H]-,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482704,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,396.15649,[M+FA]-,15.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482705,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,396.15649,[M+FA]-,15.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482706,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,396.15649,[M+FA]-,60.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482707,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,396.15649,[M+FA]-,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482708,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,396.15649,[M+FA]-,15.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482709,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,350.15102,[M-H]-,30.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482710,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,350.15102,[M-H]-,30.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482711,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,350.15102,[M-H]-,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482712,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,350.15102,[M-H]-,60.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482713,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,350.15102,[M-H]-,30.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482714,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,396.15649,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482715,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,396.15649,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482716,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,396.15649,[M+FA]-,60.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482717,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,396.15649,[M+FA]-,15.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482718,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,396.15649,[M+FA]-,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482719,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,352.16557,[M+H]+,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482720,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,352.16557,[M+H]+,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482721,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,352.16557,[M+H]+,60.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482722,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,352.16557,[M+H]+,15.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482723,Cn1c(=O)oc2c1cc(CNC(=O)NC[C@H]1C[C@@H]1c1ccccc1)cc2,352.16557,[M+H]+,20.0,val,Cn1c(=O)oc2ccc(CNC(=O)NC[C@H]3C[C@@H]3c3ccccc3)cc21
482724,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,30.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482725,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,30.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482726,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,20.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482727,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,60.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482728,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,30.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482729,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,20.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482730,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,60.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482731,COc1cccc(CN(C)C(=O)c2c3c(C)noc3nc(C3CC3)c2)c1,352.16557,[M+H]+,30.0,val,COc1cccc(CN(C)C(=O)c2cc(C3CC3)nc3onc(C)c23)c1
482732,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482733,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482734,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,60.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482735,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,15.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482736,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482737,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,45.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482738,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,60.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482739,O=C1CCCN1CCC1CN(C(=O)c2cc(=O)[nH]cc2)c2ccccc21,352.16557,[M+H]+,20.0,val,O=C1CCCN1CCC1CN(C(=O)c2cc[nH]c(=O)c2)c2ccccc21
482740,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482741,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482742,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,60.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482743,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,30.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482744,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482745,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,60.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482746,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,30.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482747,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1,352.16557,[M+H]+,20.0,val,CC(C)(C(=O)Nc1ccc(CC2NC(=O)NC2=O)cc1)c1ccccc1
482748,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,20.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482749,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,20.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482750,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,60.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482751,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,30.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482752,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,20.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482753,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,60.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482754,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,30.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482755,COc1ccc2cccc(CC(=O)N3CCCCC3c3nocn3)c2c1,352.16557,[M+H]+,20.0,val,COc1ccc2cccc(CC(=O)N3CCCCC3c3ncon3)c2c1
482756,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482757,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482758,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,30.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482759,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482760,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,15.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482761,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482762,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,60.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482763,Cc1nc2c(ccc(NC(=O)N3CCOC(Cc4ccccc4)C3)c2)o1,352.16557,[M+H]+,20.0,val,Cc1nc2cc(NC(=O)N3CCOC(Cc4ccccc4)C3)ccc2o1
482764,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1,352.16557,[M+H]+,20.0,val,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1
482765,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1,352.16557,[M+H]+,20.0,val,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1
482766,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1,352.16557,[M+H]+,60.0,val,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1
482767,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1,352.16557,[M+H]+,20.0,val,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1
482768,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1,352.16557,[M+H]+,45.0,val,O=C1CC(N2CCN(c3ccc(O)cc3)CC2)C(=O)N1c1ccccc1
482769,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,30.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482770,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,30.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482771,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,20.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482772,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,60.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482773,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,30.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482774,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,350.15102,[M-H]-,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482775,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,350.15102,[M-H]-,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482776,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,350.15102,[M-H]-,60.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482777,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,350.15102,[M-H]-,30.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482778,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,350.15102,[M-H]-,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482779,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482780,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482781,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,30.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482782,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,60.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482783,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482784,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,45.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482785,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,60.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482786,Cn1cnc2c1ccc(CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c2,352.16557,[M+H]+,20.0,val,Cn1cnc2cc(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc21
482787,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,20.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482788,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,20.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482789,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,60.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482790,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,30.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482791,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,20.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482792,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,60.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482793,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,30.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482794,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1,352.16557,[M+H]+,20.0,val,COc1ccccc1C(=O)N1CCCC(COc2cc(C#N)ccn2)C1
482795,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,20.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482796,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,20.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482797,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,60.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482798,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,30.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482799,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,20.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482800,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,30.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482801,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,60.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482802,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1,352.16557,[M+H]+,20.0,val,CC(COc1ccncc1)(COc1ccncc1)COc1ccncc1
482803,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,366.14593,[M-H]-,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482804,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,366.14593,[M-H]-,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482805,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,366.14593,[M-H]-,60.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482806,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,366.14593,[M-H]-,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482807,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,366.14593,[M-H]-,60.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482808,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482809,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482810,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,60.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482811,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,30.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482812,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482813,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,60.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482814,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,30.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482815,O=C(c1c(-c2cc3ccccc3o2)[nH]nc1)N1CCOC2(CCCOC2)C1,368.16048,[M+H]+,20.0,val,O=C(c1cn[nH]c1-c1cc2ccccc2o1)N1CCOC2(CCCOC2)C1
482816,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,366.14593,[M-H]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482817,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,366.14593,[M-H]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482818,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,366.14593,[M-H]-,60.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482819,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,366.14593,[M-H]-,15.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482820,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,366.14593,[M-H]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482821,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,412.15141,[M+FA]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482822,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,412.15141,[M+FA]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482823,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,412.15141,[M+FA]-,60.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482824,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,412.15141,[M+FA]-,15.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482825,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,412.15141,[M+FA]-,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482826,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482827,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482828,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,60.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482829,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,15.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482830,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482831,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,60.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482832,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,15.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482833,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1,368.16048,[M+H]+,20.0,val,CC(=O)Nc1ccc(N2C[C@]34C=CC(O3)C(C(=O)NC3CC3)C4C2=O)cc1
482834,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482835,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482836,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,60.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482837,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,30.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482838,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482839,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,60.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482840,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,30.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482841,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O,368.16048,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)Nc1cccc(-c2nc3ccccc3o2)c1)C(=O)O
482842,COc1ccc(C2CCCN2C(=O)c2cc3c(s2)n(C)c(=O)n(C)c3=O)cc1,400.13255,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)cc1
482843,COc1ccc(C2CCCN2C(=O)c2cc3c(s2)n(C)c(=O)n(C)c3=O)cc1,400.13255,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)cc1
482844,COc1ccc(C2CCCN2C(=O)c2cc3c(s2)n(C)c(=O)n(C)c3=O)cc1,400.13255,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)cc1
482845,COc1ccc(C2CCCN2C(=O)c2cc3c(s2)n(C)c(=O)n(C)c3=O)cc1,400.13255,[M+H]+,15.0,val,COc1ccc(C2CCCN2C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)cc1
482846,COc1ccc(C2CCCN2C(=O)c2cc3c(s2)n(C)c(=O)n(C)c3=O)cc1,400.13255,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)cc1
482847,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,398.118,[M-H]-,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482848,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,398.118,[M-H]-,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482849,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,398.118,[M-H]-,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482850,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,398.118,[M-H]-,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482851,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,398.118,[M-H]-,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482852,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,444.12348,[M+FA]-,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482853,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,444.12348,[M+FA]-,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482854,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,444.12348,[M+FA]-,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482855,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,444.12348,[M+FA]-,15.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482856,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,444.12348,[M+FA]-,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482857,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482858,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482859,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,60.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482860,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,30.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482861,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482862,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,60.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482863,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,30.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482864,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,398.118,[M-H]-,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482865,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482866,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482867,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,60.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482868,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482869,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,45.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482870,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,60.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482871,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482872,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,398.118,[M-H]-,45.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482873,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,434.09468,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482874,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,434.09468,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482875,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,434.09468,[M+Cl]-,60.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482876,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,434.09468,[M+Cl]-,15.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482877,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,434.09468,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482878,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482879,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482880,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482881,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,15.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482882,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482883,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482884,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,15.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482885,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,398.118,[M-H]-,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482886,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482887,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482888,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482889,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,30.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482890,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482891,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,60.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482892,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,30.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482893,CCOC(=O)c1c2nc(C)n(CC(=O)Nc3ccc(C)cc3)c(=O)c2c(C)s1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)Nc3ccc(C)cc3)c(C)nc12
482894,COc1cc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)ccc1,400.13255,[M+H]+,20.0,val,COc1cccc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)c1
482895,COc1cc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)ccc1,400.13255,[M+H]+,20.0,val,COc1cccc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)c1
482896,COc1cc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)ccc1,400.13255,[M+H]+,60.0,val,COc1cccc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)c1
482897,COc1cc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)ccc1,400.13255,[M+H]+,30.0,val,COc1cccc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)c1
482898,COc1cc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)ccc1,400.13255,[M+H]+,20.0,val,COc1cccc(S(=O)(=O)N2CCCC(n3cnc4ccccc4c3=O)C2)c1
482899,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482900,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482901,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482902,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482903,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482904,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482905,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482906,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482907,Cc1c(C)c(NC(=O)c2nn(C3CCS(=O)(=O)C3)c(-c3ccco3)c2)ccc1,422.11449,[M+Na]+,45.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482908,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,400.13255,[M+H]+,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482909,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,400.13255,[M+H]+,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482910,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,400.13255,[M+H]+,60.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482911,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,400.13255,[M+H]+,30.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482912,COc1cc2c(cc1)[nH]c(C)c2-c1csc(NC(=O)C2CC(=O)OC2(C)C)n1,400.13255,[M+H]+,20.0,val,COc1ccc2[nH]c(C)c(-c3csc(NC(=O)C4CC(=O)OC4(C)C)n3)c2c1
482913,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482914,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482915,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,60.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482916,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,30.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482917,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482918,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,60.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482919,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,30.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482920,CCOC(=O)c1cc(NS(=O)(=O)c2c(C)ccc(-c3n[nH]c(C)c3)c2)ccc1,400.13255,[M+H]+,20.0,val,CCOC(=O)c1cccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)ccc2C)c1
482921,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,20.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482922,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,20.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482923,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,45.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482924,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,60.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482925,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,20.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482926,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,45.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482927,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,60.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482928,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C,398.118,[M-H]-,20.0,val,COc1cc(C)c(S(=O)(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cc1C
482929,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,444.12348,[M+FA]-,15.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482930,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,444.12348,[M+FA]-,15.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482931,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,444.12348,[M+FA]-,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482932,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,444.12348,[M+FA]-,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482933,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,444.12348,[M+FA]-,15.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482934,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482935,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482936,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482937,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482938,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482939,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,60.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482940,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,30.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482941,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C,400.13255,[M+H]+,20.0,val,Cc1cccc(NC(=O)c2cc(-c3ccco3)n(C3CCS(=O)(=O)C3)n2)c1C
482942,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482943,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482944,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482945,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482946,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482947,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482948,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482949,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,462.0799,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482950,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482951,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482952,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482953,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482954,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482955,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482956,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482957,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3cc(OC)c(OC)cc3)s2)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)CCc2nnc(NC(=O)c3ccc(OC)c(OC)c3)s2)cc1
482958,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,508.08538,[M+FA]-,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482959,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,508.08538,[M+FA]-,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482960,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,508.08538,[M+FA]-,60.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482961,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,508.08538,[M+FA]-,15.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482962,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,508.08538,[M+FA]-,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482963,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482964,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482965,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,464.09445,[M+H]+,60.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482966,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,464.09445,[M+H]+,15.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482967,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,464.09445,[M+H]+,20.0,val,COc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
482968,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482969,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482970,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482971,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482972,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,45.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482973,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482974,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482975,COc1c(-c2nnc3c4ccccc4c(C)nn23)cc(S(=O)(=O)N(C)CCO)cc1,428.1387,[M+H]+,45.0,val,COc1ccc(S(=O)(=O)N(C)CCO)cc1-c1nnc2c3ccccc3c(C)nn12
482976,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,20.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482977,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,20.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482978,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,15.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482979,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,60.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482980,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,30.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482981,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,20.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482982,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,60.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482983,Cc1ccc(-c2c3nnn(Cc4nc(CO[C@H]5CCOC5)ccc4)c3nc(N)n2)o1,408.17786,[M+H]+,20.0,val,Cc1ccc(-c2nc(N)nc3c2nnn3Cc2cccc(CO[C@H]3CCOC3)n2)o1
482984,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482985,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482986,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482987,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,15.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482988,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482989,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482990,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482991,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482992,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,30.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482993,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482994,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482995,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482996,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482997,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,15.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482998,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
482999,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483000,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,15.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483001,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,518.0922,[M-H]-,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483002,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483003,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483004,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483005,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,30.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483006,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483007,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,60.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483008,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,30.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483009,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12,520.10675,[M+H]+,20.0,val,NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
483010,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,470.14297,[M-H]-,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483011,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,470.14297,[M-H]-,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483012,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,470.14297,[M-H]-,60.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483013,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,470.14297,[M-H]-,30.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483014,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,470.14297,[M-H]-,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483015,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483016,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483017,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,60.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483018,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483019,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,45.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483020,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,60.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483021,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,20.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483022,Nc1nc(=O)c2c(NCC3CN(c4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc4)C(=O)N23)[nH]1,472.15752,[M+H]+,45.0,val,Nc1nc(=O)c2c([nH]1)NCC1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)C(=O)N21
483023,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,20.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483024,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,20.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483025,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,30.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483026,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,60.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483027,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,20.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483028,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,45.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483029,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,60.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483030,CCCOc1cc2c(-c3ccccc3S(C)(=O)=O)cc(C(C)=O)n2cc1,372.1264,[M+H]+,20.0,val,CCCOc1ccn2c(C(C)=O)cc(-c3ccccc3S(C)(=O)=O)c2c1
483031,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,20.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483032,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,20.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483033,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,60.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483034,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,30.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483035,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,20.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483036,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,60.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483037,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,30.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483038,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1,388.12449,[M+H]+,20.0,val,CN(C)CCN(C(=O)CCc1ccccc1)c1nc2c(Cl)cccc2s1
483039,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,483.1187,[M+Cl]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483040,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483041,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483042,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,60.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483043,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,15.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483044,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483045,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,15.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483046,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,60.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483047,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,493.1475,[M+FA]-,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483048,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483049,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483050,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483051,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483052,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483053,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483054,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483055,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1,449.15658,[M+H]+,15.0,val,Cc1ccc(S(=O)(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c(C)c1
483056,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2nc(C(F)(F)F)ccc2)CC1,422.17984,[M+H]+,20.0,val,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2cccc(C(F)(F)F)n2)CC1
483057,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2nc(C(F)(F)F)ccc2)CC1,422.17984,[M+H]+,20.0,val,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2cccc(C(F)(F)F)n2)CC1
483058,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2nc(C(F)(F)F)ccc2)CC1,422.17984,[M+H]+,60.0,val,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2cccc(C(F)(F)F)n2)CC1
483059,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2nc(C(F)(F)F)ccc2)CC1,422.17984,[M+H]+,20.0,val,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2cccc(C(F)(F)F)n2)CC1
483060,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2nc(C(F)(F)F)ccc2)CC1,422.17984,[M+H]+,60.0,val,O=C(c1nccc(N2CCOCC2)n1)N1CCC(c2cccc(C(F)(F)F)n2)CC1
483061,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483062,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483063,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,337.15577,[M-H]-,60.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483064,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,337.15577,[M-H]-,30.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483065,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483066,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,337.15577,[M-H]-,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483067,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,337.15577,[M-H]-,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483068,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,337.15577,[M-H]-,60.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483069,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,337.15577,[M-H]-,30.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483070,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,337.15577,[M-H]-,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483071,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,383.16125,[M+FA]-,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483072,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,383.16125,[M+FA]-,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483073,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,383.16125,[M+FA]-,20.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483074,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,383.16125,[M+FA]-,60.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483075,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,383.16125,[M+FA]-,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483076,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,337.15577,[M-H]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483077,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,337.15577,[M-H]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483078,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,337.15577,[M-H]-,60.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483079,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,337.15577,[M-H]-,30.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483080,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,337.15577,[M-H]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483081,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,373.13244,[M+Cl]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483082,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483083,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483084,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,60.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483085,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,15.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483086,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483087,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,60.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483088,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,15.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483089,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,383.16125,[M+FA]-,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483090,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,337.15577,[M-H]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483091,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,337.15577,[M-H]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483092,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,337.15577,[M-H]-,60.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483093,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,337.15577,[M-H]-,15.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483094,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,337.15577,[M-H]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483095,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,373.13244,[M+Cl]-,15.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483096,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,373.13244,[M+Cl]-,60.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483097,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,373.13244,[M+Cl]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483098,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,373.13244,[M+Cl]-,15.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483099,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,383.16125,[M+FA]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483100,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,383.16125,[M+FA]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483101,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,383.16125,[M+FA]-,60.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483102,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,383.16125,[M+FA]-,15.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483103,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,383.16125,[M+FA]-,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483104,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,337.15577,[M-H]-,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483105,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,337.15577,[M-H]-,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483106,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,337.15577,[M-H]-,60.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483107,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,337.15577,[M-H]-,30.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483108,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,337.15577,[M-H]-,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483109,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,337.15577,[M-H]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483110,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,337.15577,[M-H]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483111,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,337.15577,[M-H]-,60.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483112,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,337.15577,[M-H]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483113,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,337.15577,[M-H]-,45.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483114,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,383.16125,[M+FA]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483115,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,383.16125,[M+FA]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483116,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,383.16125,[M+FA]-,60.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483117,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,383.16125,[M+FA]-,15.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483118,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,383.16125,[M+FA]-,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483119,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1,339.17032,[M+H]+,20.0,val,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1
483120,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1,339.17032,[M+H]+,20.0,val,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1
483121,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1,339.17032,[M+H]+,60.0,val,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1
483122,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1,339.17032,[M+H]+,15.0,val,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1
483123,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1,339.17032,[M+H]+,20.0,val,O=C(CN1C(=O)CCCc2ccccc21)NCCOc1ccccc1
483124,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483125,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483126,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,60.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483127,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,15.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483128,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483129,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,60.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483130,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,15.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483131,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,339.17032,[M+H]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483132,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,356.19687,[M+NH4]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483133,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,356.19687,[M+NH4]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483134,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,356.19687,[M+NH4]+,60.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483135,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,356.19687,[M+NH4]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483136,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,356.19687,[M+NH4]+,45.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483137,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,361.15226,[M+Na]+,45.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483138,CNC(=O)C1CN(C(=O)Cc2c(C)ccc(C)c2)c2ccccc2O1,361.15226,[M+Na]+,20.0,val,CNC(=O)C1CN(C(=O)Cc2cc(C)ccc2C)c2ccccc2O1
483139,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,339.17032,[M+H]+,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483140,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,339.17032,[M+H]+,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483141,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,339.17032,[M+H]+,60.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483142,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,339.17032,[M+H]+,15.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483143,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1,339.17032,[M+H]+,20.0,val,COc1cc(C)cc(CNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c1
483144,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483145,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483146,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,339.17032,[M+H]+,60.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483147,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,339.17032,[M+H]+,15.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483148,Cc1cc(O)c(NC(=O)C2CCCN2C(=O)Cc2ccccc2)cc1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN2C(=O)Cc2ccccc2)c(O)c1
483149,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,339.17032,[M+H]+,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483150,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,339.17032,[M+H]+,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483151,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,339.17032,[M+H]+,60.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483152,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,339.17032,[M+H]+,15.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483153,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1,339.17032,[M+H]+,20.0,val,CNC(=O)c1cccc(CCNC(=O)c2cccc3c2CCOC3)c1
483154,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,339.17032,[M+H]+,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483155,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,339.17032,[M+H]+,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483156,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,339.17032,[M+H]+,60.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483157,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,339.17032,[M+H]+,30.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483158,Cc1c(C(=O)O)oc(CN2CCC(c3c[nH]c4ccccc34)CC2)c1,339.17032,[M+H]+,20.0,val,Cc1cc(CN2CCC(c3c[nH]c4ccccc34)CC2)oc1C(=O)O
483159,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483160,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483161,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,60.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483162,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483163,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,45.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483164,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,60.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483165,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,20.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483166,O=C(O)C12CCC(C(=O)NCCc3cc4ccccc4nc3)(CC1)C2,339.17032,[M+H]+,45.0,val,O=C(O)C12CCC(C(=O)NCCc3cnc4ccccc4c3)(CC1)C2
483167,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,339.17032,[M+H]+,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483168,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,339.17032,[M+H]+,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483169,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,339.17032,[M+H]+,60.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483170,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,339.17032,[M+H]+,15.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483171,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC,339.17032,[M+H]+,20.0,val,COc1cccc(C(CNC(C)=O)c2c[nH]c3ccccc23)c1OC
483172,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,339.17032,[M+H]+,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483173,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,339.17032,[M+H]+,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483174,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,339.17032,[M+H]+,20.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483175,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,339.17032,[M+H]+,60.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483176,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1,339.17032,[M+H]+,15.0,val,Cc1ccc(Oc2ccccc2CNC(=O)C2CCNC(=O)C2)cc1
483177,CN(C(=O)c1cc2c(c3ccccc3oc2=O)n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483178,CN(C(=O)c1cc2c(c3ccccc3oc2=O)n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483179,CN(C(=O)c1cc2c(c3ccccc3oc2=O)n1C)C1CCCCC1,339.17032,[M+H]+,60.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483180,CN(C(=O)c1cc2c(c3ccccc3oc2=O)n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483181,CN(C(=O)c1cc2c(c3ccccc3oc2=O)n1C)C1CCCCC1,339.17032,[M+H]+,45.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483182,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,20.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483183,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,20.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483184,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,60.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483185,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,20.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483186,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,45.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483187,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,60.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483188,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,20.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483189,COc1cc2c(cc1)[C@H]1CC[N@@+]3([O-])CC=C[C@]45CC[C@@H]1[C@@]43N2C(=O)C5,339.17032,[M+H]+,45.0,val,COc1ccc2c(c1)N1C(=O)C[C@@]34C=CC[N@+]5([O-])CC[C@H]2[C@H](CC3)[C@@]145
483190,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483191,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483192,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,60.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483193,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,30.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483194,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483195,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,30.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483196,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,60.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483197,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,337.15577,[M-H]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483198,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,373.13244,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483199,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,373.13244,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483200,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,383.16125,[M+FA]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483201,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,383.16125,[M+FA]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483202,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,383.16125,[M+FA]-,60.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483203,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,383.16125,[M+FA]-,15.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483204,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,383.16125,[M+FA]-,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483205,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483206,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483207,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483208,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,30.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483209,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483210,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,30.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483211,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483212,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,337.15577,[M-H]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483213,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,373.13244,[M+Cl]-,15.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483214,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,373.13244,[M+Cl]-,15.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483215,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,373.13244,[M+Cl]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483216,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,373.13244,[M+Cl]-,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483217,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,373.13244,[M+Cl]-,15.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483218,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483219,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483220,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483221,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,15.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483222,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483223,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483224,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483225,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,383.16125,[M+FA]-,15.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483226,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,337.15577,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483227,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,337.15577,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483228,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,337.15577,[M-H]-,60.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483229,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,337.15577,[M-H]-,30.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483230,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,337.15577,[M-H]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483231,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,383.16125,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483232,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,383.16125,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483233,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,383.16125,[M+FA]-,60.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483234,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,383.16125,[M+FA]-,15.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483235,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,383.16125,[M+FA]-,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483236,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,337.15577,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483237,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,337.15577,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483238,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,337.15577,[M-H]-,60.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483239,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,337.15577,[M-H]-,30.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483240,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,337.15577,[M-H]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483241,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,373.13244,[M+Cl]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483242,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,373.13244,[M+Cl]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483243,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,373.13244,[M+Cl]-,60.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483244,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,373.13244,[M+Cl]-,15.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483245,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,373.13244,[M+Cl]-,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483246,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,383.16125,[M+FA]-,20.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483247,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,383.16125,[M+FA]-,60.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483248,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,383.16125,[M+FA]-,15.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483249,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,383.16125,[M+FA]-,20.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483250,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,337.15577,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483251,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,337.15577,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483252,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,337.15577,[M-H]-,45.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483253,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,337.15577,[M-H]-,60.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483254,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,337.15577,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483255,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,383.16125,[M+FA]-,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483256,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,383.16125,[M+FA]-,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483257,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,383.16125,[M+FA]-,60.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483258,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,337.15577,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483259,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,337.15577,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483260,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,337.15577,[M-H]-,45.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483261,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,337.15577,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483262,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,337.15577,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483263,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483264,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483265,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,60.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483266,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483267,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,60.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483268,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1,339.17032,[M+H]+,20.0,val,CN(C(=O)c1cc2c(=O)oc3ccccc3c2n1C)C1CCCCC1
483269,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483270,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483271,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,45.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483272,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,60.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483273,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483274,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,45.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483275,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,60.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483276,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21,339.17032,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(NC(=O)c3ccc(OC(C)C)cc3)cc21
483277,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,20.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483278,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,20.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483279,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,45.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483280,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,60.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483281,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,20.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483282,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,60.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483283,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,45.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483284,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21,339.17032,[M+H]+,20.0,val,CC(=O)OC(COc1cccc(C)c1)Cn1c(C)nc2ccccc21
483285,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483286,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483287,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,60.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483288,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,30.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483289,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483290,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,30.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483291,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,60.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483292,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1,339.17032,[M+H]+,20.0,val,Cc1cccc(OCC(=O)Nc2cccc(NC(=O)C3CC3)c2C)c1
483293,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,20.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483294,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,20.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483295,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,60.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483296,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,15.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483297,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,20.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483298,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,60.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483299,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,15.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483300,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1,339.17032,[M+H]+,20.0,val,CC(NC(=O)C(C)N1C(=O)C2C3C=CC(C3)C2C1=O)c1ccccc1
483301,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483302,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483303,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,60.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483304,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,30.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483305,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483306,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,20.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483307,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,60.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483308,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1,339.17032,[M+H]+,30.0,val,Cc1ccc(NC(=O)COc2ccccc2C)cc1NC(=O)C1CC1
483309,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483310,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483311,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,45.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483312,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,60.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483313,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483314,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,60.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483315,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,45.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483316,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1
483317,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483318,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483319,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,60.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483320,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,30.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483321,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483322,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,60.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483323,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,30.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483324,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1cccc(NC(=O)C2CC2)c1C
483325,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,20.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483326,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,20.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483327,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,60.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483328,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,30.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483329,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,20.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483330,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,30.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483331,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,60.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483332,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,339.17032,[M+H]+,20.0,val,Cc1cccc(C)c1N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1
483333,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,20.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483334,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,20.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483335,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,30.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483336,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,60.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483337,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,15.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483338,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,20.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483339,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,60.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483340,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1,339.17032,[M+H]+,20.0,val,COC(=O)c1cccc(CNC(=O)CN2CCc3ccccc3C2)c1
483341,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483342,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483343,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483344,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483345,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,15.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483346,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483347,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483348,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1,339.17032,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)C(C)N2C(=O)C3C4C=CC(C4)C3C2=O)c1
483349,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,321.15976,[M+H-H2O]+,20.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483350,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,321.15976,[M+H-H2O]+,20.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483351,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,321.15976,[M+H-H2O]+,15.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483352,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1,321.15976,[M+H-H2O]+,20.0,val,CC(Oc1ccccc1)C(=O)NCC(O)c1ccc2c(ccn2C)c1
483353,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483354,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483355,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,30.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483356,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,60.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483357,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483358,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,45.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483359,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,60.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483360,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1,339.17032,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CC(N(C)Cc3ccccc3)C2=O)cc1
483361,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,339.17032,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483362,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,339.17032,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483363,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,339.17032,[M+H]+,60.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483364,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,339.17032,[M+H]+,30.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483365,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1,339.17032,[M+H]+,20.0,val,Cc1ccccc1OCC(=O)NCC1CC(=O)N(c2ccccc2)C1
483366,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483367,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483368,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,60.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483369,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,30.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483370,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483371,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483372,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,30.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483373,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,339.17032,[M+H]+,60.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483374,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,356.19687,[M+NH4]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483375,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,356.19687,[M+NH4]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483376,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,356.19687,[M+NH4]+,15.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483377,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,356.19687,[M+NH4]+,60.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483378,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1,356.19687,[M+NH4]+,20.0,val,CCOc1ccccc1C(=O)Nc1ccc(C)c(N2CCCC2=O)c1
483379,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,20.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483380,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,20.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483381,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,45.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483382,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,60.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483383,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,20.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483384,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,60.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483385,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,45.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483386,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC,339.17032,[M+H]+,20.0,val,CC=C1CN2C3CC45c6ccccc6NC4(O3)C2CC1C5C(=O)OC
483387,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483388,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483389,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,60.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483390,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,30.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483391,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483392,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,45.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483393,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,60.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483394,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,353.15068,[M-H]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483395,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,389.12736,[M+Cl]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483396,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,389.12736,[M+Cl]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483397,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,389.12736,[M+Cl]-,60.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483398,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,389.12736,[M+Cl]-,15.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483399,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,389.12736,[M+Cl]-,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483400,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,355.16523,[M+H]+,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483401,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,355.16523,[M+H]+,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483402,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,355.16523,[M+H]+,60.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483403,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,355.16523,[M+H]+,15.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483404,NC(=O)c1cccc(-c2c(O)ccc(OC(=O)NC3CCCCC3)c2)c1,355.16523,[M+H]+,20.0,val,NC(=O)c1cccc(-c2cc(OC(=O)NC3CCCCC3)ccc2O)c1
483405,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,353.15068,[M-H]-,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483406,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,353.15068,[M-H]-,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483407,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,353.15068,[M-H]-,60.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483408,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,353.15068,[M-H]-,30.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483409,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,353.15068,[M-H]-,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483410,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,355.16523,[M+H]+,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483411,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,355.16523,[M+H]+,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483412,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,355.16523,[M+H]+,60.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483413,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,355.16523,[M+H]+,30.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483414,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC,355.16523,[M+H]+,20.0,val,COc1cccc(CCC(=O)NC2Cc3ccccc3NC2=O)c1OC
483415,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,353.15068,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483416,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,353.15068,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483417,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,353.15068,[M-H]-,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483418,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,353.15068,[M-H]-,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483419,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,353.15068,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483420,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,355.16523,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483421,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,355.16523,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483422,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,355.16523,[M+H]+,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483423,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,355.16523,[M+H]+,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483424,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1,355.16523,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(C)cc1
483425,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,20.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483426,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,20.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483427,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,60.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483428,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,30.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483429,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,20.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483430,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,60.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483431,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,30.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483432,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1,371.16015,[M+H]+,20.0,val,CC1CN(C(=O)C2CN(C(=O)c3ccco3)c3ccccc3O2)CC(C)O1
483433,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,20.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483434,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,20.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483435,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,60.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483436,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,30.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483437,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,20.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483438,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,60.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483439,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,30.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483440,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O,371.16015,[M+H]+,20.0,val,COC(=O)c1c(C)nc(C)c(C(=O)OCC(C)C)c1-c1ccccc1N=O
483441,COc1cc2c(c(OC)c1)c(=O)nc(-c1cc(C)c(OCCO)c(C)c1)[nH]2,371.16015,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)nc(-c3cc(C)c(OCCO)c(C)c3)[nH]c2c1
483442,COc1cc2c(c(OC)c1)c(=O)nc(-c1cc(C)c(OCCO)c(C)c1)[nH]2,371.16015,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)nc(-c3cc(C)c(OCCO)c(C)c3)[nH]c2c1
483443,COc1cc2c(c(OC)c1)c(=O)nc(-c1cc(C)c(OCCO)c(C)c1)[nH]2,371.16015,[M+H]+,60.0,val,COc1cc(OC)c2c(=O)nc(-c3cc(C)c(OCCO)c(C)c3)[nH]c2c1
483444,COc1cc2c(c(OC)c1)c(=O)nc(-c1cc(C)c(OCCO)c(C)c1)[nH]2,371.16015,[M+H]+,20.0,val,COc1cc(OC)c2c(=O)nc(-c3cc(C)c(OCCO)c(C)c3)[nH]c2c1
483445,COc1cc2c(c(OC)c1)c(=O)nc(-c1cc(C)c(OCCO)c(C)c1)[nH]2,371.16015,[M+H]+,45.0,val,COc1cc(OC)c2c(=O)nc(-c3cc(C)c(OCCO)c(C)c3)[nH]c2c1
483446,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,369.1456,[M-H]-,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483447,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,369.1456,[M-H]-,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483448,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,369.1456,[M-H]-,60.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483449,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,369.1456,[M-H]-,30.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483450,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,369.1456,[M-H]-,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483451,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483452,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483453,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,60.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483454,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,15.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483455,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483456,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,60.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483457,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,15.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483458,COc1c(OC)cc(C(=O)CCNc2cc3c(cc2)NC(=O)C(C)O3)cc1,371.16015,[M+H]+,20.0,val,COc1ccc(C(=O)CCNc2ccc3c(c2)OC(C)C(=O)N3)cc1OC
483459,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,369.1456,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483460,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,369.1456,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483461,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,369.1456,[M-H]-,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483462,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,369.1456,[M-H]-,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483463,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,369.1456,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483464,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,371.16015,[M+H]+,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483465,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,371.16015,[M+H]+,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483466,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,371.16015,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483467,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,371.16015,[M+H]+,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483468,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1,371.16015,[M+H]+,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)c1ccc(OC)cc1
483469,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483470,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483471,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,60.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483472,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483473,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,60.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483474,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,369.1456,[M-H]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483475,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,405.12227,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483476,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,405.12227,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483477,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,405.12227,[M+Cl]-,60.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483478,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,405.12227,[M+Cl]-,15.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483479,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,405.12227,[M+Cl]-,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483480,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483481,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483482,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483483,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483484,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483485,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483486,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483487,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,369.1456,[M-H]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483488,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,405.12227,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483489,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,405.12227,[M+Cl]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483490,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,405.12227,[M+Cl]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483491,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,405.12227,[M+Cl]-,15.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483492,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,415.15107,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483493,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,415.15107,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483494,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,415.15107,[M+FA]-,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483495,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,415.15107,[M+FA]-,15.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483496,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,415.15107,[M+FA]-,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483497,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,371.16015,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483498,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,371.16015,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483499,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,371.16015,[M+H]+,60.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483500,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,371.16015,[M+H]+,15.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483501,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1,371.16015,[M+H]+,20.0,val,COC(=O)c1ccc(NC(=O)c2ccnc(OCC3CCOCC3)c2)cc1
483502,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483503,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483504,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483505,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483506,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483507,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,60.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483508,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,45.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483509,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1,371.16015,[M+H]+,20.0,val,COc1cc(OC)cc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1
483510,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,20.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483511,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,20.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483512,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,60.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483513,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,15.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483514,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,20.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483515,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,60.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483516,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,15.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483517,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,381.15683,[M-H]-,20.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483518,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,383.17138,[M+H]+,15.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483519,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,383.17138,[M+H]+,15.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483520,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,383.17138,[M+H]+,20.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483521,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,383.17138,[M+H]+,60.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483522,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O,383.17138,[M+H]+,15.0,val,NC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1C(N)=O
483523,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,20.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483524,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,20.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483525,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,60.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483526,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,30.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483527,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,20.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483528,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,60.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483529,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,30.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483530,Cc1c(C(=O)NC2CCCc3nn(C)cc32)sc(Cc2ccccc2)n1,367.15871,[M+H]+,20.0,val,Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCCc2nn(C)cc21
483531,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,20.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483532,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,20.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483533,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,60.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483534,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,30.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483535,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,20.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483536,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,60.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483537,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,30.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483538,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1,367.15871,[M+H]+,20.0,val,c1ccc(-c2nc(=NCCN3CCOCC3)sn2-c2ccccc2)cc1
483539,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,20.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483540,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,20.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483541,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,60.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483542,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,30.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483543,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,20.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483544,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,20.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483545,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,30.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483546,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1,367.15871,[M+H]+,60.0,val,O=C(NCCn1cc(-c2cccnc2)cn1)C1(c2cccs2)CCCC1
483547,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,20.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483548,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,20.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483549,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,60.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483550,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,15.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483551,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,20.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483552,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,60.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483553,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,20.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483554,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1,367.15871,[M+H]+,15.0,val,O=C(CC(c1cccs1)n1cccc1)N1CCN(c2ccccn2)CC1
483555,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,437.10894,[M-H]-,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483556,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,437.10894,[M-H]-,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483557,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,437.10894,[M-H]-,60.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483558,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,437.10894,[M-H]-,30.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483559,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,437.10894,[M-H]-,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483560,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,473.08561,[M+Cl]-,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483561,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,473.08561,[M+Cl]-,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483562,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,473.08561,[M+Cl]-,30.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483563,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483564,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483565,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,60.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483566,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,15.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483567,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483568,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,60.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483569,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,15.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483570,O=C(OCc1cc(O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1cc(O)c(O)cc1,456.15004,[M+NH4]+,20.0,val,O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1
483571,COc1c(C(=O)N2C[C@@H](C)CC[C@H]2CNc2ncc(Br)cc2)cccc1F,436.10304,[M+H]+,20.0,val,COc1c(F)cccc1C(=O)N1C[C@@H](C)CC[C@H]1CNc1ccc(Br)cn1
483572,COc1c(C(=O)N2C[C@@H](C)CC[C@H]2CNc2ncc(Br)cc2)cccc1F,436.10304,[M+H]+,20.0,val,COc1c(F)cccc1C(=O)N1C[C@@H](C)CC[C@H]1CNc1ccc(Br)cn1
483573,COc1c(C(=O)N2C[C@@H](C)CC[C@H]2CNc2ncc(Br)cc2)cccc1F,436.10304,[M+H]+,60.0,val,COc1c(F)cccc1C(=O)N1C[C@@H](C)CC[C@H]1CNc1ccc(Br)cn1
483574,COc1c(C(=O)N2C[C@@H](C)CC[C@H]2CNc2ncc(Br)cc2)cccc1F,436.10304,[M+H]+,30.0,val,COc1c(F)cccc1C(=O)N1C[C@@H](C)CC[C@H]1CNc1ccc(Br)cn1
483575,COc1c(C(=O)N2C[C@@H](C)CC[C@H]2CNc2ncc(Br)cc2)cccc1F,436.10304,[M+H]+,20.0,val,COc1c(F)cccc1C(=O)N1C[C@@H](C)CC[C@H]1CNc1ccc(Br)cn1
483576,COc1c2cc(F)cc(F)c2nc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1,408.17294,[M+H]+,20.0,val,COc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2c(F)cc(F)cc12
483577,COc1c2cc(F)cc(F)c2nc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1,408.17294,[M+H]+,20.0,val,COc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2c(F)cc(F)cc12
483578,COc1c2cc(F)cc(F)c2nc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1,408.17294,[M+H]+,60.0,val,COc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2c(F)cc(F)cc12
483579,COc1c2cc(F)cc(F)c2nc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1,408.17294,[M+H]+,15.0,val,COc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2c(F)cc(F)cc12
483580,COc1c2cc(F)cc(F)c2nc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1,408.17294,[M+H]+,20.0,val,COc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2c(F)cc(F)cc12
483581,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,437.1806,[M+FA]-,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483582,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,437.1806,[M+FA]-,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483583,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,437.1806,[M+FA]-,60.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483584,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,437.1806,[M+FA]-,15.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483585,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,437.1806,[M+FA]-,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483586,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c12,393.18967,[M+H]+,20.0,val,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c21
483587,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c12,393.18967,[M+H]+,20.0,val,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c21
483588,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c12,393.18967,[M+H]+,60.0,val,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c21
483589,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c12,393.18967,[M+H]+,30.0,val,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c21
483590,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c12,393.18967,[M+H]+,20.0,val,NCC1CCCn2ncc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)c21
483591,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,20.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483592,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,20.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483593,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,60.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483594,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,20.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483595,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,45.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483596,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,60.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483597,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,20.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483598,O=C(NCC1CCN(C2CC2)CC1)c1c(C(F)(F)F)n(-c2ccccc2)nc1,393.18967,[M+H]+,45.0,val,O=C(NCC1CCN(C2CC2)CC1)c1cnn(-c2ccccc2)c1C(F)(F)F
483599,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483600,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483601,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,60.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483602,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,30.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483603,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483604,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,60.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483605,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,30.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483606,O=C(c1c(N2CCCC2)cc(C(F)(F)F)cc1)N1CCC(c2c[nH]nc2)CC1,393.18967,[M+H]+,20.0,val,O=C(c1ccc(C(F)(F)F)cc1N1CCCC1)N1CCC(c2cn[nH]c2)CC1
483607,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,371.17764,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483608,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,371.17764,[M+FA]-,15.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483609,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,371.17764,[M+FA]-,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483610,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,371.17764,[M+FA]-,15.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483611,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,371.17764,[M+FA]-,60.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483612,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483613,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483614,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,30.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483615,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,60.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483616,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,15.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483617,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483618,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,20.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483619,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1,327.18672,[M+H]+,60.0,val,O=C(NCCCc1ccccc1)NCC1(c2ccc(F)cc2)CC1
483620,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483621,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483622,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,45.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483623,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,60.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483624,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483625,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,60.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483626,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,45.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483627,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1,431.166,[M+H]+,20.0,val,CC(C)n1cnc(S(=O)(=O)N2CCN(c3ncnc(-c4ccccc4)c3F)CC2)c1
483628,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,426.16053,[M+FA]-,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483629,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,426.16053,[M+FA]-,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483630,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,426.16053,[M+FA]-,60.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483631,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,426.16053,[M+FA]-,15.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483632,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,426.16053,[M+FA]-,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483633,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483634,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483635,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,45.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483636,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,60.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483637,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483638,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,60.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483639,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,45.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483640,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2,382.16961,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccccn23)CC1)c1cc2c(s1)CCCC2
483641,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1,382.16961,[M+H]+,20.0,val,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1
483642,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1,382.16961,[M+H]+,20.0,val,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1
483643,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1,382.16961,[M+H]+,45.0,val,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1
483644,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1,382.16961,[M+H]+,60.0,val,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1
483645,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1,382.16961,[M+H]+,20.0,val,O=C(CSc1ccncc1)N1CC2CN(c3ccc(C4CC4)nn3)CC2C1
483646,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1,382.16961,[M+H]+,20.0,val,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1
483647,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1,382.16961,[M+H]+,20.0,val,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1
483648,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1,382.16961,[M+H]+,45.0,val,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1
483649,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1,382.16961,[M+H]+,60.0,val,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1
483650,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1,382.16961,[M+H]+,20.0,val,Cc1ccc(-c2nc3sc(N4CCCCC4)nn3c2NC(=O)C2CC2)cc1
483651,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,20.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483652,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,20.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483653,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,45.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483654,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,60.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483655,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,20.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483656,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,45.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483657,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,60.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483658,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12,382.16961,[M+H]+,20.0,val,Cc1cccc2nnc(N3CCN(C(=O)c4cc5c(s4)CCCC5)CC3)n12
483659,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483660,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483661,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483662,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,15.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483663,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483664,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483665,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483666,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1,394.1986,[M+H]+,15.0,val,CC(C)Oc1ccc(C(=O)N2CCN(c3ccc(-n4cncn4)nn3)CC2)cc1
483667,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,374.15981,[M+H]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483668,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,374.15981,[M+H]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483669,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,374.15981,[M+H]+,60.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483670,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,374.15981,[M+H]+,15.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483671,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,374.15981,[M+H]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483672,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,391.18636,[M+NH4]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483673,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,391.18636,[M+NH4]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483674,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,391.18636,[M+NH4]+,60.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483675,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,391.18636,[M+NH4]+,20.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483676,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1,391.18636,[M+NH4]+,45.0,val,CCOC(=O)c1ccc(CNC(=O)C2(C)COC(c3ccccc3)OC2)o1
483677,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,20.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483678,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,20.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483679,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,60.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483680,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,20.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483681,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,45.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483682,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,60.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483683,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,20.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483684,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,436.0894,[M-H]-,45.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483685,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1,472.06608,[M+Cl]-,20.0,val,CC(C)Oc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CCS(=O)(=O)C2)cc1
483686,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1,446.11861,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1
483687,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1,446.11861,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1
483688,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1,446.11861,[M+H]+,60.0,val,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1
483689,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1,446.11861,[M+H]+,30.0,val,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1
483690,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1,446.11861,[M+H]+,20.0,val,C/C(=N\NC(=O)c1nn(C)c(C)c1Br)c1ccc(NC(=O)C2CCCC2)cc1
483691,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,20.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483692,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,20.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483693,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,60.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483694,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,20.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483695,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,45.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483696,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,60.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483697,Cc1nc2c(CCC2)c(N2CC3CN(C(=O)c4cn(C)nc4C(F)F)CC3C2)n1,403.20524,[M+H]+,20.0,val,Cc1nc2c(c(N3CC4CN(C(=O)c5cn(C)nc5C(F)F)CC4C3)n1)CCC2
483698,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,410.1697,[M-H]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483699,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,410.1697,[M-H]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483700,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,410.1697,[M-H]-,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483701,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,410.1697,[M-H]-,30.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483702,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,410.1697,[M-H]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483703,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,446.14638,[M+Cl]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483704,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,446.14638,[M+Cl]-,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483705,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,446.14638,[M+Cl]-,15.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483706,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483707,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483708,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483709,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,15.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483710,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483711,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483712,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,15.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483713,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,456.17518,[M+FA]-,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483714,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483715,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483716,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483717,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,30.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483718,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483719,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,60.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483720,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,30.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483721,Cc1c(CCC(=O)NC2(c3cc(OC(F)(F)F)ccc3)CCOCC2)cnn1C,412.18425,[M+H]+,20.0,val,Cc1c(CCC(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cnn1C
483722,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,438.17585,[M-H]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483723,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,438.17585,[M-H]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483724,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,438.17585,[M-H]-,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483725,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,438.17585,[M-H]-,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483726,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,474.15253,[M+Cl]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483727,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,474.15253,[M+Cl]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483728,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,474.15253,[M+Cl]-,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483729,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,474.15253,[M+Cl]-,15.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483730,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483731,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483732,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483733,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,15.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483734,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483735,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483736,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,15.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483737,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,484.18133,[M+FA]-,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483738,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483739,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483740,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,45.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483741,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483742,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483743,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,20.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483744,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,60.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483745,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O,440.1904,[M+H]+,45.0,val,Cn1nc(C2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)n(C2CC2)c1=O
483746,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,20.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483747,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,20.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483748,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,60.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483749,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,15.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483750,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,20.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483751,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,60.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483752,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,15.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483753,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1,357.16312,[M+H]+,20.0,val,CC(C)C1CN(C(=O)C(Cc2ccccc2)NC(=O)c2cccs2)C1
483754,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,20.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483755,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,20.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483756,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,60.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483757,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,30.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483758,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,20.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483759,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,60.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483760,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,30.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483761,CCN(CC)CCNc1c2c(=O)c3ccccc3sc2c(CO)cc1,357.16312,[M+H]+,20.0,val,CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12
483762,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1,357.16312,[M+H]+,20.0,val,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1
483763,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1,357.16312,[M+H]+,20.0,val,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1
483764,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1,357.16312,[M+H]+,45.0,val,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1
483765,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1,357.16312,[M+H]+,60.0,val,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1
483766,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1,357.16312,[M+H]+,20.0,val,O=C(c1ccc(-c2ccsc2)cc1)N1CCCN(C2CCOC2)CC1
483767,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,375.14809,[M+Cl]-,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483768,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,375.14809,[M+Cl]-,60.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483769,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,375.14809,[M+Cl]-,15.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483770,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483771,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483772,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,60.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483773,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,15.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483774,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483775,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,60.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483776,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,15.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483777,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,385.1769,[M+FA]-,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483778,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483779,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483780,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483781,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483782,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483783,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)c2cc(C3CC3)nc3ccccc23)CC1
483784,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483785,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483786,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,341.18597,[M+H]+,15.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483787,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,341.18597,[M+H]+,60.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483788,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccccc1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O
483789,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1,341.18597,[M+H]+,20.0,val,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1
483790,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1,341.18597,[M+H]+,20.0,val,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1
483791,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1,341.18597,[M+H]+,60.0,val,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1
483792,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1,341.18597,[M+H]+,15.0,val,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1
483793,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1,341.18597,[M+H]+,20.0,val,O=C(COc1ccc(OCc2ccccc2)cc1)N1CCCNCC1
483794,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,20.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483795,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,20.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483796,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,60.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483797,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,20.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483798,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,45.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483799,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,60.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483800,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,20.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483801,COc1cc2cc(C(=O)N3CCOCC4(CCC4)C3)c(C)nc2cc1,341.18597,[M+H]+,45.0,val,COc1ccc2nc(C)c(C(=O)N3CCOCC4(CCC4)C3)cc2c1
483802,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,20.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483803,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,20.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483804,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,30.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483805,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,60.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483806,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,20.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483807,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,45.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483808,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,60.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483809,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1,341.18597,[M+H]+,20.0,val,COCC1(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)CCNC1
483810,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483811,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483812,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,60.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483813,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483814,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,45.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483815,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,60.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483816,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483817,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,341.18597,[M+H]+,45.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483818,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483819,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483820,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,60.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483821,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,30.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483822,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483823,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,60.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483824,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,30.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483825,COc1ccc(CC2CCN(C(=O)C(O)c3cnccc3)CC2)cc1,358.21252,[M+NH4]+,20.0,val,COc1ccc(CC2CCN(C(=O)C(O)c3cccnc3)CC2)cc1
483826,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483827,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483828,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,60.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483829,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483830,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,60.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483831,Cc1nc2c(cc1)cc(C(=O)N1CC(C)OC3(CCOCC3)C1)cc2,341.18597,[M+H]+,20.0,val,Cc1ccc2cc(C(=O)N3CC(C)OC4(CCOCC4)C3)ccc2n1
483832,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483833,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483834,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,45.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483835,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,60.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483836,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483837,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,45.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483838,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,60.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483839,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,339.17142,[M-H]-,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483840,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,375.14809,[M+Cl]-,15.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483841,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,375.14809,[M+Cl]-,15.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483842,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,375.14809,[M+Cl]-,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483843,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,375.14809,[M+Cl]-,60.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483844,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,375.14809,[M+Cl]-,15.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483845,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483846,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483847,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483848,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,30.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483849,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483850,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,30.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483851,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483852,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,339.17142,[M-H]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483853,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,385.1769,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483854,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,385.1769,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483855,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,385.1769,[M+FA]-,60.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483856,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,385.1769,[M+FA]-,15.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483857,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,385.1769,[M+FA]-,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483858,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483859,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483860,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,60.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483861,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,30.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483862,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483863,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,30.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483864,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483865,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,339.17142,[M-H]-,60.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483866,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,375.14809,[M+Cl]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483867,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,375.14809,[M+Cl]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483868,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,375.14809,[M+Cl]-,60.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483869,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,375.14809,[M+Cl]-,15.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483870,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,375.14809,[M+Cl]-,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483871,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,339.17142,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483872,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,339.17142,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483873,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,339.17142,[M-H]-,60.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483874,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,339.17142,[M-H]-,30.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483875,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,339.17142,[M-H]-,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483876,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,20.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483877,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,20.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483878,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,60.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483879,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,15.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483880,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,20.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483881,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,60.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483882,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,15.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483883,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12,341.18597,[M+H]+,20.0,val,COc1cc(OC)c(OC)cc1CNCCc1c[nH]c2ccccc12
483884,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483885,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483886,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,60.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483887,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,30.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483888,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483889,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483890,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,60.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483891,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1,341.18597,[M+H]+,30.0,val,Cc1cc(C)cc(C(=O)N2CCCC(C(=O)NCc3ccco3)C2)c1
483892,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483893,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483894,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483895,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,30.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483896,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483897,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483898,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483899,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O,341.18597,[M+H]+,30.0,val,CCc1cccc(C)c1NC(=O)CC(NCc1ccccc1)C(=O)O
483900,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483901,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483902,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,60.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483903,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,30.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483904,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483905,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,45.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483906,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,20.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483907,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1,341.18597,[M+H]+,60.0,val,CC(C)(CC(=O)O)CC(=O)Nc1cccc(CCc2ccncc2)c1
483908,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483909,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483910,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,60.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483911,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,30.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483912,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483913,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,30.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483914,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,60.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483915,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1,341.18597,[M+H]+,20.0,val,COC(=O)N1CCC(CNC(=O)Cc2cccc3ccccc23)CC1
483916,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,341.18597,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483917,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,341.18597,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483918,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,341.18597,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483919,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,341.18597,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483920,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1,341.18597,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1
483921,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,341.18597,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483922,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,341.18597,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483923,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,341.18597,[M+H]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483924,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,341.18597,[M+H]+,30.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483925,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,341.18597,[M+H]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483926,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,363.16791,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483927,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,363.16791,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483928,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,363.16791,[M+Na]+,45.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483929,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,363.16791,[M+Na]+,60.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483930,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1,363.16791,[M+Na]+,20.0,val,CC(=O)Nc1cccc(NC(=O)C(C)Oc2ccc(C(C)C)cc2)c1
483931,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1,341.18597,[M+H]+,20.0,val,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1
483932,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1,341.18597,[M+H]+,20.0,val,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1
483933,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1,341.18597,[M+H]+,60.0,val,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1
483934,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1,341.18597,[M+H]+,15.0,val,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1
483935,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1,341.18597,[M+H]+,20.0,val,CCCOc1ccccc1C(=O)N(CCC(N)=O)Cc1ccccc1
483936,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,20.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483937,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,20.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483938,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,60.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483939,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,15.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483940,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,20.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483941,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,20.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483942,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,15.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483943,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1,341.18597,[M+H]+,60.0,val,CCN(C(=O)c1ccnc(OCC2CCOCC2)c1)c1ccccc1
483944,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C,341.18597,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C
483945,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C,341.18597,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C
483946,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C,341.18597,[M+H]+,60.0,val,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C
483947,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C,341.18597,[M+H]+,15.0,val,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C
483948,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C,341.18597,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCCC(Oc3ccncc3)C2)cc1C
483949,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483950,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483951,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483952,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483953,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483954,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483955,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483956,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,323.17541,[M+H-H2O]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483957,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483958,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483959,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483960,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483961,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483962,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483963,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483964,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1,341.18597,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
483965,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483966,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483967,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,60.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483968,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,15.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483969,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483970,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,60.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483971,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,15.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483972,O=C1CCCCCN1C(=O)c1cc(C(=O)N2CCCCCC2=O)ccc1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483973,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,20.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483974,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,20.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483975,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,60.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483976,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,30.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483977,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,20.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483978,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,60.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483979,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,30.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483980,COc1cc(OC)c(/C(C)=N/N=C(\C)c2c(OC)cc(OC)cc2)cc1,357.18088,[M+H]+,20.0,val,COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
483981,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483982,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483983,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,60.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483984,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,15.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483985,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483986,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,60.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483987,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,20.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483988,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1,357.18088,[M+H]+,15.0,val,O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1
483989,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483990,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483991,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,60.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483992,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483993,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,45.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483994,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,60.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483995,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483996,Cc1nccn1-c1c(CNC(c2ccccc2)C(C)C)cccn1,321.20737,[M+H]+,45.0,val,Cc1nccn1-c1ncccc1CNC(c1ccccc1)C(C)C
483997,Cc1c(C)cc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1,321.20737,[M+H]+,20.0,val,Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C
483998,Cc1c(C)cc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1,321.20737,[M+H]+,20.0,val,Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C
483999,Cc1c(C)cc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1,321.20737,[M+H]+,60.0,val,Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C
484000,Cc1c(C)cc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1,321.20737,[M+H]+,30.0,val,Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C
484001,Cc1c(C)cc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1,321.20737,[M+H]+,20.0,val,Cc1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1C
484002,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1
484003,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1
484004,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1,321.20737,[M+H]+,60.0,val,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1
484005,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1,321.20737,[M+H]+,15.0,val,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1
484006,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1cc(N2CCCC2)n2ncc(-c3ccccc3)c2n1
484007,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484008,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484009,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,60.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484010,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,30.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484011,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484012,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,30.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484013,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,60.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484014,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1,321.20737,[M+H]+,20.0,val,CC(C)(C)c1nc2ccccc2n1C1CN(Cc2cccnc2)C1
484015,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,20.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484016,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,20.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484017,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,60.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484018,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,20.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484019,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,60.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484020,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1,321.20737,[M+H]+,20.0,val,c1ccc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)cc1
484021,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,343.1551,[M-H]-,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484022,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,343.1551,[M-H]-,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484023,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,343.1551,[M-H]-,60.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484024,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,343.1551,[M-H]-,30.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484025,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,343.1551,[M-H]-,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484026,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,343.1551,[M-H]-,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484027,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,343.1551,[M-H]-,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484028,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,343.1551,[M-H]-,60.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484029,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,343.1551,[M-H]-,30.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484030,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,343.1551,[M-H]-,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484031,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484032,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484033,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,60.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484034,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484035,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,60.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484036,CC(C)c1c(O)c(O)c2c(c1)C(=O)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484037,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,327.15909,[M+H-H2O]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484038,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,327.15909,[M+H-H2O]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484039,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,327.15909,[M+H-H2O]+,60.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484040,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,327.15909,[M+H-H2O]+,15.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484041,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,327.15909,[M+H-H2O]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484042,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484043,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484044,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,327.15909,[M+H-H2O]+,60.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484045,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,327.15909,[M+H-H2O]+,15.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484046,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484047,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,367.15159,[M+Na]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484048,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,367.15159,[M+Na]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484049,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,367.15159,[M+Na]+,30.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484050,C/C=C/c1cc(OC)c(OC(C)C(O)c2cc(OC)c(O)cc2)cc1,367.15159,[M+Na]+,20.0,val,C/C=C/c1ccc(OC(C)C(O)c2ccc(O)c(OC)c2)c(OC)c1
484051,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,367.15159,[M+Na]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484052,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,367.15159,[M+Na]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484053,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,367.15159,[M+Na]+,30.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484054,COc1c(O)ccc(CCC(O)CC(=O)CCc2ccc(O)cc2)c1,367.15159,[M+Na]+,20.0,val,COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O
484055,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,345.16965,[M+H]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484056,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,345.16965,[M+H]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484057,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,345.16965,[M+H]+,60.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484058,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,345.16965,[M+H]+,15.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484059,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,345.16965,[M+H]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484060,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484061,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484062,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,60.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484063,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,15.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484064,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484065,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,60.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484066,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,15.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484067,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1cocc1)OC2=O,362.1962,[M+NH4]+,20.0,val,C[C@@H]1CC[C@]2(C)C3(C)CC[C@@]2(OC3=O)[C@@]12C[C@H](c1ccoc1)OC2=O
484068,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484069,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484070,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,327.15909,[M+H-H2O]+,60.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484071,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,327.15909,[M+H-H2O]+,30.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484072,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,327.15909,[M+H-H2O]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484073,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,362.1962,[M+NH4]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484074,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,362.1962,[M+NH4]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484075,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,362.1962,[M+NH4]+,60.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484076,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,362.1962,[M+NH4]+,15.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484077,COc1c(O)ccc(C2OC(c3cc(OC)c(O)cc3)C(C)C2C)c1,362.1962,[M+NH4]+,20.0,val,COc1cc(C2OC(c3ccc(O)c(OC)c3)C(C)C2C)ccc1O
484078,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,20.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484079,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,20.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484080,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,30.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484081,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,60.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484082,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,15.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484083,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,20.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484084,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,60.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484085,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC,345.16965,[M+H]+,20.0,val,CCOc1cc(C(=O)c2ccccc2OCC)c(OCC)cc1OC
484086,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484087,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484088,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,60.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484089,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484090,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,60.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484091,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O,343.1551,[M-H]-,20.0,val,CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1[C@H](OC3=O)C2=O
484092,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,427.10193,[M+Cl]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484093,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,427.10193,[M+Cl]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484094,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,427.10193,[M+Cl]-,15.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484095,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,427.10193,[M+Cl]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484096,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484097,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,60.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484098,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,15.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484099,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484100,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,60.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484101,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,15.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484102,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,437.13073,[M+FA]-,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484103,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,375.12924,[M+H-H2O]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484104,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,375.12924,[M+H-H2O]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484105,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,375.12924,[M+H-H2O]+,60.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484106,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,375.12924,[M+H-H2O]+,15.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484107,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1,375.12924,[M+H-H2O]+,20.0,val,CC(O)c1ccc(C2(CNC(=O)NCc3ccc(Cl)cc3)CCCC2)s1
484108,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,423.13284,[M-H]-,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484109,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,423.13284,[M-H]-,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484110,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,423.13284,[M-H]-,60.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484111,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,423.13284,[M-H]-,30.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484112,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,423.13284,[M-H]-,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484113,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,425.14739,[M+H]+,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484114,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,425.14739,[M+H]+,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484115,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,425.14739,[M+H]+,60.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484116,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,425.14739,[M+H]+,30.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484117,CCOc1c(O)c(Cl)cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)c1,425.14739,[M+H]+,20.0,val,CCOc1cc(C2NC(=O)N(C)C(C)=C2C(=O)OCC2CCCO2)cc(Cl)c1O
484118,CC(O)c1c(Sc2ccccc2CN2CCN(C)CC2)ccc(Cl)c1,377.14489,[M+H]+,20.0,val,CC(O)c1cc(Cl)ccc1Sc1ccccc1CN1CCN(C)CC1
484119,CC(O)c1c(Sc2ccccc2CN2CCN(C)CC2)ccc(Cl)c1,377.14489,[M+H]+,20.0,val,CC(O)c1cc(Cl)ccc1Sc1ccccc1CN1CCN(C)CC1
484120,CC(O)c1c(Sc2ccccc2CN2CCN(C)CC2)ccc(Cl)c1,377.14489,[M+H]+,60.0,val,CC(O)c1cc(Cl)ccc1Sc1ccccc1CN1CCN(C)CC1
484121,CC(O)c1c(Sc2ccccc2CN2CCN(C)CC2)ccc(Cl)c1,377.14489,[M+H]+,30.0,val,CC(O)c1cc(Cl)ccc1Sc1ccccc1CN1CCN(C)CC1
484122,CC(O)c1c(Sc2ccccc2CN2CCN(C)CC2)ccc(Cl)c1,377.14489,[M+H]+,20.0,val,CC(O)c1cc(Cl)ccc1Sc1ccccc1CN1CCN(C)CC1
484123,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484124,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484125,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484126,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484127,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484128,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484129,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484130,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484131,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484132,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484133,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccc(C)cc2)n1
484134,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484135,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484136,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,60.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484137,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,30.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484138,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484139,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,60.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484140,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,30.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484141,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,451.10347,[M-H]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484142,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484143,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484144,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,487.08015,[M+Cl]-,60.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484145,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,487.08015,[M+Cl]-,15.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484146,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,487.08015,[M+Cl]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484147,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,497.10895,[M+FA]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484148,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,497.10895,[M+FA]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484149,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,497.10895,[M+FA]-,60.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484150,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,497.10895,[M+FA]-,15.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484151,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,497.10895,[M+FA]-,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484152,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484153,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484154,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,451.10347,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484155,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,451.10347,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484156,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484157,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,487.08015,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484158,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,487.08015,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484159,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484160,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484161,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,451.10347,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484162,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,451.10347,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484163,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,451.10347,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484164,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,453.11802,[M+H]+,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484165,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,453.11802,[M+H]+,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484166,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,453.11802,[M+H]+,60.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484167,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,453.11802,[M+H]+,30.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484168,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1,453.11802,[M+H]+,20.0,val,CCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)NCc2ccc(C)cc2)n1
484169,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484170,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484171,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,453.11802,[M+H]+,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484172,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,453.11802,[M+H]+,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484173,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(C)c2)n1
484174,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484175,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484176,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,453.11802,[M+H]+,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484177,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,453.11802,[M+H]+,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484178,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1,453.11802,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2C)n1
484179,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,20.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484180,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,20.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484181,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,60.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484182,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,20.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484183,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,45.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484184,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,60.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484185,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,20.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484186,CCCOc1nc(C)nc(N2CCN(C(=O)c3c(OC)ccc(Cl)c3)CC2)c1,405.16879,[M+H]+,45.0,val,CCCOc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1
484187,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484188,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484189,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484190,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484191,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484192,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484193,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484194,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484195,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484196,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484197,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,467.09838,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484198,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,467.09838,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484199,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,467.09838,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484200,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,503.07506,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484201,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,503.07506,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484202,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,503.07506,[M+Cl]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484203,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,503.07506,[M+Cl]-,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484204,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,503.07506,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484205,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,513.10386,[M+FA]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484206,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,513.10386,[M+FA]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484207,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,513.10386,[M+FA]-,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484208,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,513.10386,[M+FA]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484209,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,513.10386,[M+FA]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484210,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484211,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484212,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,469.11294,[M+H]+,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484213,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,469.11294,[M+H]+,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484214,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2ccccc2OC)n1
484215,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484216,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484217,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,469.11294,[M+H]+,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484218,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,469.11294,[M+H]+,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484219,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cc(OC)ccc2)n1,469.11294,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(CCSC)C(=O)Nc2cccc(OC)c2)n1
484220,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,439.19625,[M+FA]-,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484221,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,439.19625,[M+FA]-,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484222,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,439.19625,[M+FA]-,60.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484223,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,439.19625,[M+FA]-,15.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484224,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,439.19625,[M+FA]-,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484225,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,395.20532,[M+H]+,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484226,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,395.20532,[M+H]+,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484227,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,395.20532,[M+H]+,60.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484228,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,395.20532,[M+H]+,15.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484229,CN1CCN(C(CNC(=O)c2cc(C(F)(F)F)ccc2)c2cccn2C)CC1,395.20532,[M+H]+,20.0,val,CN1CCN(C(CNC(=O)c2cccc(C(F)(F)F)c2)c2cccn2C)CC1
484230,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,20.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484231,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,20.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484232,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,45.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484233,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,60.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484234,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,20.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484235,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,20.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484236,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,60.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484237,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21,395.20532,[M+H]+,45.0,val,CC(C)n1c(N2CC3CN(C(=O)CCC(F)(F)F)CC3C2)nc2ccccc21
484238,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,20.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484239,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,20.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484240,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,30.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484241,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,60.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484242,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,20.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484243,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,45.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484244,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,60.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484245,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1,455.2013,[M+H]+,20.0,val,NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1
484246,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484247,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484248,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484249,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484250,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484251,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,60.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484252,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,30.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484253,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1,421.17042,[M+H]+,20.0,val,O=C(COc1ccc(F)cc1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
484254,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,354.18232,[M-H]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484255,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,354.18232,[M-H]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484256,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,354.18232,[M-H]-,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484257,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,354.18232,[M-H]-,30.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484258,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,354.18232,[M-H]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484259,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,390.15899,[M+Cl]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484260,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,390.15899,[M+Cl]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484261,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,390.15899,[M+Cl]-,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484262,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,390.15899,[M+Cl]-,30.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484263,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,390.15899,[M+Cl]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484264,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484265,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484266,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484267,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,15.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484268,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484269,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484270,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,15.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484271,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,400.18779,[M+FA]-,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484272,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484273,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484274,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484275,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484276,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,45.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484277,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484278,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484279,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,354.18232,[M-H]-,45.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484280,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,390.15899,[M+Cl]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484281,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,390.15899,[M+Cl]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484282,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,390.15899,[M+Cl]-,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484283,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,390.15899,[M+Cl]-,30.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484284,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,390.15899,[M+Cl]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484285,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,400.18779,[M+FA]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484286,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,400.18779,[M+FA]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484287,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,400.18779,[M+FA]-,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484288,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,400.18779,[M+FA]-,15.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484289,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,400.18779,[M+FA]-,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484290,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,20.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484291,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,20.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484292,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,60.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484293,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,30.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484294,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,20.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484295,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,60.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484296,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,30.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484297,CO[C@@H]1C[C@@H](COc2cnccc2)N(CC(=O)NCc2ccccc2)C1,356.19687,[M+H]+,20.0,val,CO[C@@H]1C[C@@H](COc2cccnc2)N(CC(=O)NCc2ccccc2)C1
484298,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484299,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484300,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484301,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484302,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,45.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484303,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484304,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484305,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1,356.19687,[M+H]+,45.0,val,O=C1c2ccccc2C(=O)N1CCN1CCCC(N2CCCCC2=O)C1
484306,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,20.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484307,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,20.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484308,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,60.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484309,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,20.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484310,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,45.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484311,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,60.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484312,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,20.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484313,COCC1(CNC(=O)c2c(N(C)C)ccnc2)OCCc2ccccc21,356.19687,[M+H]+,45.0,val,COCC1(CNC(=O)c2cnccc2N(C)C)OCCc2ccccc21
484314,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484315,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484316,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,30.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484317,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484318,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,15.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484319,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484320,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,60.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484321,Cc1c(C)c(Oc2ncc(NC(=O)NC3(C)CCOCC3)cc2)ccc1,356.19687,[M+H]+,20.0,val,Cc1cccc(Oc2ccc(NC(=O)NC3(C)CCOCC3)cn2)c1C
484322,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,20.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484323,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,20.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484324,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,60.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484325,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,30.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484326,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,20.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484327,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,60.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484328,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,30.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484329,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2,356.19687,[M+H]+,20.0,val,CCn1nc(C(=O)N2CCOc3ccccc3C2)c2c1[C@H](C)O[C@H](C)C2
484330,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484331,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484332,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484333,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484334,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484335,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484336,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,30.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484337,Cc1c(-n2cccn2)ccc(C(=O)N2CCOC3(CCOCC3)CC2)c1,356.19687,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCOC3(CCOCC3)CC2)ccc1-n1cccn1
484338,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484339,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484340,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,30.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484341,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,60.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484342,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484343,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,45.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484344,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,60.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484345,COc1c(OC)cc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(NC(=O)CN2CCC(c3ccccn3)CC2)cc1OC
484346,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,20.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484347,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,20.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484348,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,60.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484349,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,30.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484350,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,20.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484351,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,60.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484352,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,30.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484353,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1,356.19687,[M+H]+,20.0,val,O=C(C1CCCCN1Cc1cc(-c2ccccc2)no1)N1CCOCC1
484354,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484355,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484356,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484357,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484358,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,45.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484359,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484360,COc1cc(OC)c(C2CCCN2C(=O)c2cnc3CCCCn23)cc1,356.19687,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)c2cnc3n2CCCC3)c(OC)c1
484361,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484362,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484363,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484364,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,30.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484365,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484366,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,60.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484367,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,30.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484368,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1,356.19687,[M+H]+,20.0,val,CC1(C(=O)NC2CC(=O)N(C3CC3c3ccccc3)C2)CCC(=O)NC1
484369,COc1cc2nc(N3CCOC(C(=O)N4CCCC4)C3)cc(C)c2cc1,356.19687,[M+H]+,20.0,val,COc1ccc2c(C)cc(N3CCOC(C(=O)N4CCCC4)C3)nc2c1
484370,COc1cc2nc(N3CCOC(C(=O)N4CCCC4)C3)cc(C)c2cc1,356.19687,[M+H]+,20.0,val,COc1ccc2c(C)cc(N3CCOC(C(=O)N4CCCC4)C3)nc2c1
484371,COc1cc2nc(N3CCOC(C(=O)N4CCCC4)C3)cc(C)c2cc1,356.19687,[M+H]+,60.0,val,COc1ccc2c(C)cc(N3CCOC(C(=O)N4CCCC4)C3)nc2c1
484372,COc1cc2nc(N3CCOC(C(=O)N4CCCC4)C3)cc(C)c2cc1,356.19687,[M+H]+,20.0,val,COc1ccc2c(C)cc(N3CCOC(C(=O)N4CCCC4)C3)nc2c1
484373,COc1cc2nc(N3CCOC(C(=O)N4CCCC4)C3)cc(C)c2cc1,356.19687,[M+H]+,45.0,val,COc1ccc2c(C)cc(N3CCOC(C(=O)N4CCCC4)C3)nc2c1
484374,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484375,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484376,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484377,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484378,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484379,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484380,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484381,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,354.18232,[M-H]-,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484382,O=C(Cn1nc2CCCCCc2cc1=O)N[C@H](CO)Cc1ccccc1,338.18631,[M+H-H2O]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCCC2)N[C@H](CO)Cc1ccccc1
484383,O=C(Cn1nc2CCCCCc2cc1=O)N[C@H](CO)Cc1ccccc1,338.18631,[M+H-H2O]+,60.0,val,O=C(Cn1nc2c(cc1=O)CCCCC2)N[C@H](CO)Cc1ccccc1
484384,O=C(Cn1nc2CCCCCc2cc1=O)N[C@H](CO)Cc1ccccc1,338.18631,[M+H-H2O]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCCC2)N[C@H](CO)Cc1ccccc1
484385,O=C(Cn1nc2CCCCCc2cc1=O)N[C@H](CO)Cc1ccccc1,338.18631,[M+H-H2O]+,20.0,val,O=C(Cn1nc2c(cc1=O)CCCCC2)N[C@H](CO)Cc1ccccc1
484386,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484387,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484388,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484389,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484390,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484391,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,60.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484392,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,15.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484393,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1,356.19687,[M+H]+,20.0,val,Cc1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2CCCCC2)no1
484394,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,354.18232,[M-H]-,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484395,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,354.18232,[M-H]-,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484396,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,354.18232,[M-H]-,60.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484397,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,354.18232,[M-H]-,30.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484398,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,354.18232,[M-H]-,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484399,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484400,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484401,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484402,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484403,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484404,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,354.18232,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484405,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484406,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484407,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484408,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,30.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484409,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484410,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484411,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,30.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484412,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1,356.19687,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1
484413,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484414,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484415,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,60.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484416,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,15.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484417,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484418,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,60.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484419,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,20.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484420,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1,356.19687,[M+H]+,15.0,val,CC(C)(C)n1nc(C2CCC(=O)C2)cc1NC(=O)OCc1ccccc1
484421,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,434.12137,[M-H]-,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484422,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,434.12137,[M-H]-,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484423,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,434.12137,[M-H]-,45.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484424,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,434.12137,[M-H]-,60.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484425,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,434.12137,[M-H]-,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484426,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484427,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484428,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,60.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484429,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,30.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484430,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484431,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,20.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484432,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,30.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484433,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1,436.13592,[M+H]+,60.0,val,CCOc1ccc(OCC)c(NS(=O)(=O)c2c(C)sc(C)c2-c2cc(C)[nH]n2)c1
484434,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2,445.1114,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2
484435,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2,445.1114,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2
484436,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2,445.1114,[M+H]+,60.0,val,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2
484437,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2,445.1114,[M+H]+,30.0,val,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2
484438,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2,445.1114,[M+H]+,20.0,val,CC1(C)C2CCC1(CS(=O)(=O)N1CCN(c3cc(Cl)ccc3Cl)CC1)C(=O)C2
484439,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,309.19724,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484440,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,309.19724,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484441,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,309.19724,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484442,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,309.19724,[M-H]-,45.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484443,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,355.20272,[M+FA]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484444,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,355.20272,[M+FA]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484445,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,355.20272,[M+FA]-,60.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484446,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,355.20272,[M+FA]-,15.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484447,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,355.20272,[M+FA]-,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484448,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484449,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484450,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484451,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484452,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484453,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484454,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,30.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484455,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)NC3CCC(C)CC3)c(C)[nH]2)cc1
484456,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484457,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484458,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,60.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484459,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484460,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,45.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484461,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,60.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484462,CCN(CC)c1cc(O)c(C=Nc2c(C)cc(C)cc2C)cc1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484463,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484464,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484465,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,60.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484466,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484467,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,60.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484468,CCCCCNc1c2C(=O)CC(C)(C)Cc2nc2ccccc12,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484469,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,20.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484470,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,20.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484471,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,60.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484472,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,30.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484473,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,20.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484474,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,30.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484475,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,60.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484476,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1,311.21179,[M+H]+,20.0,val,CC(C)Cc1ccc(C(C)C(=O)NCCc2ccccn2)cc1
484477,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484478,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484479,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,60.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484480,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,30.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484481,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484482,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,60.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484483,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,30.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484484,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(COc2cccc(CNCC3CCNCC3)c2)cc1
484485,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484486,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484487,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O,311.21179,[M+H]+,60.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484488,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O,311.21179,[M+H]+,20.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484489,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O,311.21179,[M+H]+,60.0,val,CCCCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O
484490,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,20.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484491,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,20.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484492,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,60.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484493,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,30.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484494,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,20.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484495,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,60.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484496,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,20.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484497,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1,311.21179,[M+H]+,30.0,val,CC(C)(C)NC(=O)C1CCN(Cc2cccc3ccccc23)C1
484498,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1,311.21179,[M+H]+,20.0,val,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1
484499,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1,311.21179,[M+H]+,20.0,val,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1
484500,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1,311.21179,[M+H]+,60.0,val,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1
484501,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1,311.21179,[M+H]+,30.0,val,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1
484502,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1,311.21179,[M+H]+,20.0,val,CCn1cc(-c2ccc(C)cc2)cc1C(=O)N1CCCC(C)C1
484503,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484504,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484505,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,60.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484506,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,30.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484507,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484508,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,60.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484509,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,30.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484510,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1,311.21179,[M+H]+,20.0,val,c1ccc(-c2ccc(CNCCCN3CCOCC3)cc2)cc1
484511,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,20.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484512,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,20.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484513,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,60.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484514,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,30.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484515,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,20.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484516,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,60.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484517,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,30.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484518,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1,311.21179,[M+H]+,20.0,val,CO[C@H]1CNCC[C@H]1N(Cc1ccccc1)Cc1ccccc1
484519,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1
484520,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1
484521,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1,311.21179,[M+H]+,60.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1
484522,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1,311.21179,[M+H]+,30.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1
484523,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3C)CC2)cc1
484524,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,293.20123,[M+H-H2O]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484525,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,293.20123,[M+H-H2O]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484526,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,293.20123,[M+H-H2O]+,45.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484527,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,293.20123,[M+H-H2O]+,60.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484528,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,293.20123,[M+H-H2O]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484529,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484530,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484531,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,311.21179,[M+H]+,60.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484532,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,311.21179,[M+H]+,30.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484533,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1,311.21179,[M+H]+,20.0,val,Cc1ccc(C(O)CN2CCN(c3ccccc3)CC2)c(C)c1
484534,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484535,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484536,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1,311.21179,[M+H]+,60.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484537,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1,311.21179,[M+H]+,20.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484538,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1,311.21179,[M+H]+,60.0,val,CCN(CC)c1ccc(C=Nc2c(C)cc(C)cc2C)c(O)c1
484539,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,20.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484540,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,20.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484541,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,60.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484542,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,15.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484543,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,20.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484544,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,15.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484545,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,20.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484546,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C,311.21179,[M+H]+,60.0,val,COc1ccc(CN2CCN(c3ccccc3C)CC2)cc1C
484547,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,20.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484548,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,20.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484549,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,60.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484550,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,30.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484551,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,20.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484552,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,60.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484553,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,20.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484554,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2,407.14576,[M+H]+,30.0,val,O=S(=O)(NCC(c1cccs1)N1CCOCC1)c1ccc2c(c1)CCCC2
484555,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,20.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484556,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,20.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484557,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,60.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484558,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,15.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484559,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,20.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484560,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,60.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484561,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,15.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484562,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1,403.1976,[M+H]+,20.0,val,Cc1cc(N2C[C@]34C=CC(O3)C(C(=O)NCCCN3CCOCC3)C4C2=O)no1
484563,Cc1c(C(C)C)nc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)s1,374.18967,[M+H]+,20.0,val,Cc1sc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)nc1C(C)C
484564,Cc1c(C(C)C)nc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)s1,374.18967,[M+H]+,20.0,val,Cc1sc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)nc1C(C)C
484565,Cc1c(C(C)C)nc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)s1,374.18967,[M+H]+,60.0,val,Cc1sc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)nc1C(C)C
484566,Cc1c(C(C)C)nc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)s1,374.18967,[M+H]+,15.0,val,Cc1sc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)nc1C(C)C
484567,Cc1c(C(C)C)nc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)s1,374.18967,[M+H]+,20.0,val,Cc1sc(CC(=O)N2CCC(O)(Cc3ccncc3)CC2)nc1C(C)C
484568,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,20.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484569,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,20.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484570,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,60.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484571,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,30.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484572,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,20.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484573,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,60.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484574,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,30.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484575,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1,374.18967,[M+H]+,20.0,val,CCc1csc(CC(=O)NC(CN2CCOCC2)c2ccc(C)cc2)n1
484576,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,20.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484577,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,20.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484578,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,30.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484579,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,60.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484580,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,20.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484581,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,30.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484582,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,60.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484583,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1,406.1795,[M+H]+,20.0,val,O=C1CCCN1Cc1ccc(C(=O)N2CCCC(N3CCCS3(=O)=O)C2)cc1
484584,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,20.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484585,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,20.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484586,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,60.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484587,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,30.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484588,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,20.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484589,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,30.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484590,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,60.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484591,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1,406.1795,[M+H]+,20.0,val,CCOc1ccc(CNS(=O)(=O)c2cc(C(=O)N3CCCC3)n(C)c2C)cc1
484592,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484593,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484594,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,45.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484595,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,60.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484596,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484597,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,45.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484598,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,60.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484599,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,420.15987,[M-H]-,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484600,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484601,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484602,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,60.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484603,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484604,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,60.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484605,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484606,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,456.13654,[M+Cl]-,15.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484607,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,456.13654,[M+Cl]-,15.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484608,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,456.13654,[M+Cl]-,60.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484609,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484610,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484611,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,60.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484612,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,15.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484613,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484614,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484615,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484616,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,45.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484617,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,60.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484618,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484619,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,45.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484620,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,60.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484621,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,420.15987,[M-H]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484622,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,456.13654,[M+Cl]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484623,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,456.13654,[M+Cl]-,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484624,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,456.13654,[M+Cl]-,60.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484625,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484626,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484627,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,60.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484628,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,420.15987,[M-H]-,60.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484629,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484630,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484631,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,60.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484632,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,15.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484633,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,466.16534,[M+FA]-,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484634,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1
484635,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1
484636,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1,422.17442,[M+H]+,60.0,val,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1
484637,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1,422.17442,[M+H]+,30.0,val,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1
484638,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)c2cc(S(=O)(=O)N3CCCC(C)C3)cn2C)c1
484639,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484640,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484641,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,60.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484642,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,30.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484643,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484644,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,60.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484645,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,30.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484646,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1,422.17442,[M+H]+,20.0,val,CCc1noc(NC(C)=O)c1-c1ccc(OC)c(S(=O)(=O)N2CCC(C)CC2)c1
484647,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484648,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484649,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,60.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484650,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,30.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484651,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484652,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,60.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484653,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,30.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484654,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCC4)CC3)cc2NC1=O
484655,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484656,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484657,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,15.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484658,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,60.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484659,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,30.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484660,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484661,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,20.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484662,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1,422.17442,[M+H]+,60.0,val,COc1ccc(OC)c(CNC(=O)c2[nH]c(C)c(S(=O)(=O)N3CCCC3)c2C)c1
484663,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484664,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484665,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,60.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484666,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,30.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484667,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O,422.17442,[M+H]+,20.0,val,CCC1Oc2ccc(S(=O)(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2NC1=O
484668,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484669,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484670,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484671,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484672,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484673,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484674,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484675,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484676,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484677,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484678,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484679,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484680,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484681,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484682,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484683,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484684,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484685,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484686,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484687,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484688,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,404.18271,[M-H]-,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484689,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484690,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484691,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484692,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484693,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484694,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,60.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484695,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,30.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484696,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O,406.19726,[M+H]+,20.0,val,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
484697,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,20.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484698,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,20.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484699,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,60.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484700,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,20.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484701,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,45.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484702,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,60.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484703,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,20.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484704,CCOC(=O)c1c(C)c2c(cccc2OCC(O)CN2CCCCC2)o1,362.1962,[M+H]+,45.0,val,CCOC(=O)c1oc2cccc(OCC(O)CN3CCCCC3)c2c1C
484705,CCCCc1cc(=O)oc2c1ccc(O)c2CN[C@H](C(=O)O)[C@H](C)CC,362.1962,[M+H]+,30.0,val,CCCCc1cc(=O)oc2c(CN[C@H](C(=O)O)[C@H](C)CC)c(O)ccc12
484706,CCCCc1cc(=O)oc2c1ccc(O)c2CN[C@H](C(=O)O)[C@H](C)CC,362.1962,[M+H]+,30.0,val,CCCCc1cc(=O)oc2c(CN[C@H](C(=O)O)[C@H](C)CC)c(O)ccc12
484707,CCCCc1cc(=O)oc2c1ccc(O)c2CN[C@H](C(=O)O)[C@H](C)CC,362.1962,[M+H]+,20.0,val,CCCCc1cc(=O)oc2c(CN[C@H](C(=O)O)[C@H](C)CC)c(O)ccc12
484708,CCCCc1cc(=O)oc2c1ccc(O)c2CN[C@H](C(=O)O)[C@H](C)CC,362.1962,[M+H]+,60.0,val,CCCCc1cc(=O)oc2c(CN[C@H](C(=O)O)[C@H](C)CC)c(O)ccc12
484709,CCCCc1cc(=O)oc2c1ccc(O)c2CN[C@H](C(=O)O)[C@H](C)CC,362.1962,[M+H]+,30.0,val,CCCCc1cc(=O)oc2c(CN[C@H](C(=O)O)[C@H](C)CC)c(O)ccc12
484710,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,428.15132,[M+Cl]-,15.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484711,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,428.15132,[M+Cl]-,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484712,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,428.15132,[M+Cl]-,60.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484713,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,428.15132,[M+Cl]-,15.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484714,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484715,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484716,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,60.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484717,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,15.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484718,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484719,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,60.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484720,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,15.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484721,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484722,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484723,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484724,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,60.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484725,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,15.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484726,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484727,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,60.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484728,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,15.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484729,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,438.18012,[M+FA]-,20.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
484730,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484731,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484732,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,30.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484733,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,60.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484734,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484735,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,45.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484736,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,60.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484737,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cc(Cl)ccc1,394.18919,[M+H]+,20.0,val,O=C(NCC(=O)N1CCC(CCN2CCOCC2)CC1)c1cccc(Cl)c1
484738,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,394.18919,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484739,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,394.18919,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484740,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,394.18919,[M+H]+,60.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484741,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,394.18919,[M+H]+,30.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484742,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2,394.18919,[M+H]+,20.0,val,CC(=O)N1CCN(C(=O)NCCc2ccc(Cl)cc2)CCC12CCOCC2
484743,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cc(Cl)ccc3)C2)CC1,394.18919,[M+H]+,20.0,val,CC(=O)N1CCC(CNC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)CC1
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484922,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,411.16606,[M-H]-,20.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484923,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,411.16606,[M-H]-,60.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484924,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,411.16606,[M-H]-,15.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484925,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,411.16606,[M-H]-,20.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484926,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,411.16606,[M-H]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484927,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,411.16606,[M-H]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484928,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,411.16606,[M-H]-,60.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484929,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,411.16606,[M-H]-,15.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484930,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,411.16606,[M-H]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484931,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,457.17153,[M+FA]-,20.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484932,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,457.17153,[M+FA]-,20.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484933,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,457.17153,[M+FA]-,60.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484934,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,457.17153,[M+FA]-,30.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484935,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O,457.17153,[M+FA]-,20.0,val,CC1=CC2C(O)(CC(CO)C3(O)OOC(C)(C)C4C(=O)C(O)C(C)C2(O)C43)C1=O
484936,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,457.17153,[M+FA]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484937,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,457.17153,[M+FA]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484938,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,457.17153,[M+FA]-,60.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484939,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,457.17153,[M+FA]-,30.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484940,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O,457.17153,[M+FA]-,20.0,val,CC1C(O)C(=O)C2C3C(OOC2(C)C)C(CO)CC2(O)C(=O)C(C)(O)C=C2C13O
484941,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,20.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484942,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,20.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484943,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,60.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484944,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,15.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484945,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,20.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484946,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,60.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484947,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,15.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484948,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,413.18061,[M+H]+,20.0,val,CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1
484949,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,447.14273,[M+Cl]-,30.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484950,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,20.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484951,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,20.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484952,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,60.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484953,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,30.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484954,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,20.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484955,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,30.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484956,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,60.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484957,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O,457.17153,[M+FA]-,20.0,val,CC1=C[C@H](O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O
484958,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,20.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484959,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,20.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484960,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,60.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484961,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,20.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484962,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,45.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484963,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,60.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484964,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,20.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484965,Cc1nc2c(CCCC2)c(N(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1,373.25105,[M+H]+,45.0,val,Cc1nc2c(c(N(C)C[C@@H]3C[C@H](F)CN3Cc3nccn3C)n1)CCCC2
484966,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484967,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484968,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,60.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484969,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,30.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484970,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484971,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,60.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484972,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,30.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484973,CCOc1c(OCC)cc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1,376.22308,[M+H]+,20.0,val,CCOc1ccc(C(=O)NCC(=O)N2CCN3CCCC3C2)cc1OCC
484974,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,20.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484975,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,20.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484976,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,60.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484977,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,30.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484978,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,20.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484979,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,20.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484980,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,30.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484981,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1,376.22308,[M+H]+,60.0,val,CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccnc(OCC2CC2)c1
484982,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,416.23033,[M+FA]-,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
484983,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,416.23033,[M+FA]-,60.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
484984,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,416.23033,[M+FA]-,15.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
484985,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,416.23033,[M+FA]-,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
484986,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,416.23033,[M+FA]-,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
484987,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,416.23033,[M+FA]-,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
484988,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,416.23033,[M+FA]-,60.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
484989,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,416.23033,[M+FA]-,15.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
484990,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,416.23033,[M+FA]-,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
484991,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,416.23033,[M+FA]-,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
484992,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,416.23033,[M+FA]-,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
484993,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,416.23033,[M+FA]-,60.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
484994,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,416.23033,[M+FA]-,15.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
484995,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,416.23033,[M+FA]-,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
484996,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,370.22485,[M-H]-,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
484997,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,370.22485,[M-H]-,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
484998,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,370.22485,[M-H]-,60.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
484999,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,370.22485,[M-H]-,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485000,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,370.22485,[M-H]-,45.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485001,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485002,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485003,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,60.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485004,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,30.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485005,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485006,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,60.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485007,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,30.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485008,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1,372.2394,[M+H]+,20.0,val,O=C(NCCN1CCc2ccccc2C1)N1CCC(N2CCNC2=O)CC1
485009,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,20.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485010,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,20.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485011,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,60.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485012,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,20.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485013,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,45.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485014,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,60.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485015,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,20.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485016,Cc1c(C)c(N2CC[C@@H](N)C2)nc(C(=O)N2CC=CCC23CCOCC3)n1,372.2394,[M+H]+,45.0,val,Cc1nc(C(=O)N2CC=CCC23CCOCC3)nc(N2CC[C@@H](N)C2)c1C
485017,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485018,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485019,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,60.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485020,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,30.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485021,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485022,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,60.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485023,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,30.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485024,CC(=O)NC[C@@H]1CN(C(=O)c2c(C)n(C(C)C)cc2)C[C@H]1c1cncn1C,372.2394,[M+H]+,20.0,val,CC(=O)NC[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1cncn1C
485025,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485026,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485027,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,60.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485028,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,30.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485029,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485030,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,60.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485031,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,30.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485032,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1,372.2394,[M+H]+,20.0,val,CC(C)C(CNC(=O)NCc1ccccc1-n1ccnc1)N1CCOCC1
485033,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485034,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485035,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,60.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485036,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,15.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485037,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485038,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,60.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485039,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,15.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485040,CCC(C)n1ncc(C(=O)Nc2cc(OCCN(C)C)ncc2)c1C1CC1,372.2394,[M+H]+,20.0,val,CCC(C)n1ncc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1C1CC1
485041,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485042,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485043,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,60.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485044,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485045,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,45.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485046,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,60.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485047,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485048,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,370.22485,[M-H]-,45.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485049,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,354.22884,[M+H-H2O]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485050,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,354.22884,[M+H-H2O]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485051,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,354.22884,[M+H-H2O]+,60.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485052,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,354.22884,[M+H-H2O]+,45.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485053,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485054,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485055,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,60.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485056,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,30.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485057,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485058,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,60.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485059,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,30.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485060,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1,372.2394,[M+H]+,20.0,val,O=C(CC1(n2cccc2)CCOCC1)Nc1n[nH]c(CCC2CCCC2)n1
485061,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21,404.21147,[M+H]+,20.0,val,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21
485062,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21,404.21147,[M+H]+,20.0,val,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21
485063,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21,404.21147,[M+H]+,60.0,val,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21
485064,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21,404.21147,[M+H]+,15.0,val,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21
485065,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21,404.21147,[M+H]+,20.0,val,Cn1c(N2CC3CN(S(=O)(=O)N4CCCCCC4)CC3C2)nc2ccccc21
485066,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485067,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485068,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485069,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485070,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485071,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,60.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485072,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,30.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485073,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1,348.21693,[M+H]+,20.0,val,COCC1(O)CCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)CC1
485074,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1,348.21693,[M+H]+,20.0,val,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1
485075,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1,348.21693,[M+H]+,20.0,val,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1
485076,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1,348.21693,[M+H]+,45.0,val,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1
485077,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1,348.21693,[M+H]+,60.0,val,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1
485078,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1,348.21693,[M+H]+,20.0,val,CCOC(=O)C1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1
485079,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,20.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485080,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,20.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485081,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,15.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485082,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,60.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485083,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,30.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485084,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,20.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485085,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,60.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485086,COc1c(OC)cc(C(C)NC(=O)CN2CCOC3(CCC3)C2)c(C)c1,363.22783,[M+H]+,20.0,val,COc1cc(C)c(C(C)NC(=O)CN2CCOC3(CCC3)C2)cc1OC
485087,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,397.18996,[M+Cl]-,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485088,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,397.18996,[M+Cl]-,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485089,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,397.18996,[M+Cl]-,15.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485090,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,407.21876,[M+FA]-,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485091,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,407.21876,[M+FA]-,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485092,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,407.21876,[M+FA]-,60.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485093,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,407.21876,[M+FA]-,15.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485094,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,407.21876,[M+FA]-,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485095,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,407.21876,[M+FA]-,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485096,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,407.21876,[M+FA]-,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485097,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,407.21876,[M+FA]-,60.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485098,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,407.21876,[M+FA]-,15.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485099,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,407.21876,[M+FA]-,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485100,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,363.22783,[M+H]+,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485101,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,363.22783,[M+H]+,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485102,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,363.22783,[M+H]+,60.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485103,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,363.22783,[M+H]+,15.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485104,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C,363.22783,[M+H]+,20.0,val,CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)CC(C)C
485105,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485106,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485107,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,60.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485108,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,15.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485109,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485110,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,60.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485111,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,15.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485112,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1,363.22783,[M+H]+,20.0,val,CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
485113,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485114,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485115,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,60.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485116,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,15.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485117,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485118,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,60.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485119,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,15.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485120,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485121,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485122,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485123,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,60.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485124,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,15.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485125,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485126,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,60.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485127,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,15.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485128,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1,363.22783,[M+H]+,20.0,val,COC(=O)Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1
485129,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,20.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485130,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,20.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485131,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,60.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485132,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,15.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485133,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,20.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485134,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,60.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485135,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,20.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485136,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1,363.22783,[M+H]+,15.0,val,CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1N[C@H](C)c1ccccc1
485137,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,341.23469,[M-H]-,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485138,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,341.23469,[M-H]-,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485139,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,341.23469,[M-H]-,60.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485140,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,341.23469,[M-H]-,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485141,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,341.23469,[M-H]-,45.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485142,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,377.21136,[M+Cl]-,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485143,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,377.21136,[M+Cl]-,15.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485144,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,377.21136,[M+Cl]-,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485145,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485146,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485147,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,60.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485148,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,30.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485149,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485150,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,60.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485151,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,30.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485152,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1,343.24924,[M+H]+,20.0,val,CN(C)CC1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CC1
485153,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O,535.1527,[M+H]+,20.0,val,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O
485154,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O,535.1527,[M+H]+,20.0,val,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O
485155,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O,535.1527,[M+H]+,60.0,val,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O
485156,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O,535.1527,[M+H]+,30.0,val,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O
485157,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O,535.1527,[M+H]+,20.0,val,O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCCC(=O)ON1C(=O)CC(S(=O)(=O)O)C1=O
485158,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1,394.23365,[M+H]+,20.0,val,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1
485159,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1,394.23365,[M+H]+,20.0,val,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1
485160,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1,394.23365,[M+H]+,60.0,val,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1
485161,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1,394.23365,[M+H]+,30.0,val,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1
485162,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1,394.23365,[M+H]+,20.0,val,O=c1occ(CN2CCOCC2)c(O)c1CN1CCN(C2CCOCC2)CC1
485163,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,20.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485164,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,20.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485165,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,60.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485166,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,20.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485167,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,45.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485168,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,60.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485169,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,20.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485170,O=C(CN1CCC(N(c2ncncc2)C2CC2)CC1)N1CCCCCC1,358.26014,[M+H]+,45.0,val,O=C(CN1CCC(N(c2ccncn2)C2CC2)CC1)N1CCCCCC1
485171,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,20.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485172,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,20.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485173,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,45.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485174,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,60.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485175,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,20.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485176,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,45.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485177,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,60.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485178,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1,358.26014,[M+H]+,20.0,val,CCN1CCN(CC#CCOC2CCN(c3cncc(C)n3)CC2)CC1
485179,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485180,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485181,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,60.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485182,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485183,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,45.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485184,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,60.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485185,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485186,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,381.2384,[M+H]+,45.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485187,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,403.22034,[M+Na]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485188,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,403.22034,[M+Na]+,60.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485189,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,403.22034,[M+Na]+,20.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485190,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21,403.22034,[M+Na]+,60.0,val,CC1(C)CN(C(=O)COCC(=O)N2CC(C)(C)[C@H]3COC[C@H]32)[C@H]2COC[C@H]21
485191,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,20.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485192,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,20.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485193,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,60.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485194,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,20.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485195,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,45.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485196,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,60.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485197,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,20.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485198,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1,345.26489,[M+H]+,45.0,val,CN1CCC(C(=O)NCC2CCC3(CC2)CC3)C(c2ccnn2C)C1
485199,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,20.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485200,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,20.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485201,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,60.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485202,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,30.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485203,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,20.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485204,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,60.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485205,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,30.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485206,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1,345.26489,[M+H]+,20.0,val,CCn1cc(C2CCN(C(=O)NCCC3=CCCCCC3)CC2)cn1
485207,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,20.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485208,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,20.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485209,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,60.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485210,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,20.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485211,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,20.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485212,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1,345.26489,[M+H]+,60.0,val,CC(C)(C)c1ccc(N2CC3CN(CC4CCCOC4)CC3C2)nn1
485213,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,20.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485214,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,20.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485215,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,60.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485216,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,30.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485217,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,20.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485218,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,20.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485219,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,30.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485220,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O,304.26349,[M+H]+,60.0,val,CC(C)(C)c1cc(CN2CCCCC2)cc(C(C)(C)C)c1O
485221,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1,389.26705,[M-H]-,20.0,val,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1
485222,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1,389.26705,[M-H]-,20.0,val,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1
485223,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1,389.26705,[M-H]-,60.0,val,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1
485224,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1,389.26705,[M-H]-,20.0,val,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1
485225,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1,389.26705,[M-H]-,45.0,val,CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1
485226,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,591.1778,[M+FA]-,20.0,val,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
485227,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,591.1778,[M+FA]-,20.0,val,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
485228,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,591.1778,[M+FA]-,60.0,val,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
485229,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,591.1778,[M+FA]-,15.0,val,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
485230,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,591.1778,[M+FA]-,20.0,val,OC1OC[C@@H](O[C@@H]2OC[C@@H](O[C@@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
485231,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO,367.249,[M+FA]-,20.0,val,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO
485232,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO,367.249,[M+FA]-,60.0,val,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO
485233,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO,367.249,[M+FA]-,15.0,val,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO
485234,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO,367.249,[M+FA]-,20.0,val,CC1(C)CCC[C@]2(C)C1CC=C(CO)[C@H]2CC/C(=C/CO)CO
485235,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O,321.24352,[M-H]-,20.0,val,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O
485236,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O,321.24352,[M-H]-,20.0,val,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O
485237,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O,321.24352,[M-H]-,60.0,val,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O
485238,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O,321.24352,[M-H]-,20.0,val,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O
485239,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O,321.24352,[M-H]-,60.0,val,C=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CC(=O)O
485240,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485241,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485242,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,60.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485243,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,30.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485244,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485245,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,60.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485246,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,30.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485247,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,459.24604,[M-H]-,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485248,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485249,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485250,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,60.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485251,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,15.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485252,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485253,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,60.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485254,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,15.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485255,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O,461.26059,[M+H]+,20.0,val,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
485256,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O,273.25769,[M+H-2H2O]+,30.0,val,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O
485257,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O,273.25769,[M+H-2H2O]+,30.0,val,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O
485258,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O,273.25769,[M+H-2H2O]+,20.0,val,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O
485259,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O,273.25769,[M+H-2H2O]+,60.0,val,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O
485260,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O,273.25769,[M+H-2H2O]+,30.0,val,C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O
485261,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,20.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485262,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,20.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485263,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,60.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485264,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,30.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485265,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,20.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485266,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,60.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485267,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,30.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485268,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C,273.25769,[M+H-2H2O]+,20.0,val,C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(C)CCCC21C
485269,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,338.27007,[M-H]-,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485270,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,338.27007,[M-H]-,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485271,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,338.27007,[M-H]-,60.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485272,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,338.27007,[M-H]-,30.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485273,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,338.27007,[M-H]-,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485274,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,340.28462,[M+H]+,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485275,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,340.28462,[M+H]+,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485276,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,340.28462,[M+H]+,60.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485277,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,340.28462,[M+H]+,15.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485278,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O,340.28462,[M+H]+,20.0,val,CCCCCCCC/C=C\CCCCCCCC(=O)NCC(=O)O
485279,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,20.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485280,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,20.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485281,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,60.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485282,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,30.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485283,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,20.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485284,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,60.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485285,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,30.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485286,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O,421.22655,[M-H]-,20.0,val,CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
485287,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2c(Cl)cc(C(F)(F)F)cn2)cc1,553.00651,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2ncc(C(F)(F)F)cc2Cl)cc1
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485292,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2c(Cl)cc(C(F)(F)F)cn2)cc1,553.00651,[M-H]-,60.0,val,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2ncc(C(F)(F)F)cc2Cl)cc1
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485294,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2c(Cl)cc(C(F)(F)F)cn2)cc1,553.00651,[M-H]-,20.0,val,O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2ncc(C(F)(F)F)cc2Cl)cc1
485295,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,403.08797,[M-H]-,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485296,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,403.08797,[M-H]-,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485297,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,403.08797,[M-H]-,60.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485298,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,403.08797,[M-H]-,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485299,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,403.08797,[M-H]-,45.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485300,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,405.10253,[M+H]+,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485301,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,405.10253,[M+H]+,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485302,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,405.10253,[M+H]+,60.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485303,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,405.10253,[M+H]+,20.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485304,N#Cc1c(Nc2cc(Cl)c(F)cc2)c2cc(NCc3cnccc3)ncc2nc1,405.10253,[M+H]+,45.0,val,N#Cc1cnc2cnc(NCc3cccnc3)cc2c1Nc1ccc(F)c(Cl)c1
485305,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485306,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485307,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485308,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,30.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485309,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485310,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485311,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,30.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485312,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,533.09777,[M-H]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485313,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485314,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485315,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485316,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,15.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485317,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485318,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485319,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,15.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485320,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,569.07445,[M+Cl]-,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485321,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485322,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485323,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485324,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485325,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,45.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485326,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,60.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485327,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,20.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485328,OC(CNc1nc(-c2nn(Cc3ccccc3F)c(-c3nocc3)c2)ncc1F)(C(F)(F)F)C(F)(F)F,535.11233,[M+H]+,45.0,val,OC(CNc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)ncc1F)(C(F)(F)F)C(F)(F)F
485329,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,20.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485330,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,20.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485331,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,60.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485332,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,15.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485333,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,20.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485334,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,20.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485335,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,15.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485336,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N,512.03003,[M-H]-,60.0,val,CCOC(=O)c1c(Nc2ccccc2C(F)(F)F)sc(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1N
485337,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485338,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485339,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485340,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485341,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485342,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485343,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485344,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485345,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485346,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485347,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485348,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485349,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485350,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485351,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485352,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485353,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485354,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485355,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485356,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485357,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485358,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485359,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485360,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485361,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485362,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485363,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485364,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485365,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485366,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485367,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485368,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485369,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485370,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485371,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485372,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485373,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485374,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485375,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485376,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485377,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485378,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485379,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485380,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485381,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485382,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485383,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485384,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485385,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485386,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485387,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485388,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485389,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485390,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485391,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485392,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485393,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485394,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485395,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485396,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485397,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485398,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485399,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485400,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485401,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485402,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485403,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485404,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485405,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485406,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485407,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485408,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485409,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485410,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,30.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485411,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485412,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485413,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,30.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485414,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485415,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485416,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485417,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485418,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485419,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485420,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485421,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485422,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485423,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485424,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485425,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485426,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485427,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485428,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485429,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485430,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485431,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485432,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485433,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485434,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485435,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485436,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485437,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485438,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485439,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485440,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485441,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485442,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,30.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485443,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485444,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485445,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,481.06961,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485446,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485447,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485448,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485449,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485450,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485451,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485452,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485453,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,517.04628,[M+Cl]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485454,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485455,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485456,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485457,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,15.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485458,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,527.07508,[M+FA]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485459,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485460,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485461,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485462,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485463,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485464,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485465,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485466,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485467,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485468,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485469,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485470,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485471,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485472,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485473,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485474,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485475,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485476,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485477,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485478,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485479,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485480,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485481,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485482,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(F)(F)F)c(Cl)cc3)cc2)c1,483.08416,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)ccn1
485483,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,20.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485484,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,20.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485485,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,60.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485486,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,15.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485487,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,20.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485488,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,60.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485489,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl,347.09457,[M+H]+,20.0,val,O=c1c2ccccc2nc(Cc2ccccc2)n1-c1ccccc1Cl
485490,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485491,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485492,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,45.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485493,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,60.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485494,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485495,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,45.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485496,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,60.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485497,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,411.10743,[M-H]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485498,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,447.08411,[M+Cl]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485499,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,447.08411,[M+Cl]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485500,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,447.08411,[M+Cl]-,60.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485501,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,447.08411,[M+Cl]-,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485502,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,413.12199,[M+H]+,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485503,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,413.12199,[M+H]+,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485504,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,413.12199,[M+H]+,60.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485505,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,413.12199,[M+H]+,30.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485506,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1,413.12199,[M+H]+,20.0,val,O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(OC(F)(F)F)cc1
485507,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,459.07442,[M-H]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485508,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,459.07442,[M-H]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485509,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,459.07442,[M-H]-,60.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485510,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,459.07442,[M-H]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485511,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,459.07442,[M-H]-,45.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485512,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,495.0511,[M+Cl]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485513,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,495.0511,[M+Cl]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485514,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,495.0511,[M+Cl]-,60.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485515,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,495.0511,[M+Cl]-,15.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485516,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,505.0799,[M+FA]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485517,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,505.0799,[M+FA]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485518,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,505.0799,[M+FA]-,60.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485519,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,505.0799,[M+FA]-,15.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485520,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,505.0799,[M+FA]-,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485521,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,461.08897,[M+H]+,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485522,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,461.08897,[M+H]+,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485523,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,461.08897,[M+H]+,60.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485524,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,461.08897,[M+H]+,20.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485525,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1,461.08897,[M+H]+,45.0,val,O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1)c1cnc2[nH]ncc2c1
485526,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1,346.10738,[M+H]+,20.0,val,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1
485527,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1,346.10738,[M+H]+,20.0,val,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1
485528,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1,346.10738,[M+H]+,60.0,val,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1
485529,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1,346.10738,[M+H]+,20.0,val,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1
485530,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1,346.10738,[M+H]+,60.0,val,Cc1ccccc1-c1cc2oc(=O)cc(O)c2c(=O)n1-c1ccccc1
485531,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,20.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485532,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,20.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485533,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,45.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485534,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,60.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485535,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,20.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485536,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,45.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485537,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,60.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485538,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O,346.10738,[M+H]+,20.0,val,Cc1cc(NC(=O)c2ccco2)ccc1-c1cc2ccccc2oc1=O
485539,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C,454.03969,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C
485540,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C,454.03969,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C
485541,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C,454.03969,[M+H]+,45.0,val,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C
485542,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C,454.03969,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C
485543,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C,454.03969,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)c(=O)n(-c2ccccc2)n1C
485544,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1,434.0611,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1
485545,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1,434.0611,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1
485546,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1,434.0611,[M+H]+,60.0,val,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1
485547,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1,434.0611,[M+H]+,30.0,val,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1
485548,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1,434.0611,[M+H]+,20.0,val,O=C(Cn1nnnc1-c1ccc(Br)cc1)N(c1ccccc1)c1ccccc1
485549,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485550,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485551,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485552,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485553,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485554,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485555,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485556,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485557,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485558,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485559,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485560,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485561,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485562,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485563,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485564,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,376.09253,[M-H]-,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485565,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485566,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485567,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485568,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485569,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485570,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485571,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485572,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485573,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485574,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485575,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485576,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485577,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485578,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,60.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485579,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,30.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485580,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1,378.10709,[M+H]+,20.0,val,C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
485581,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O,359.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O
485582,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O,359.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O
485583,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O,359.10373,[M-H]-,60.0,val,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O
485584,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O,359.10373,[M-H]-,15.0,val,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O
485585,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O,359.10373,[M-H]-,20.0,val,O=C(Nc1ccccc1)c1ccccc1NC(=O)c1ccccc1C(=O)O
485586,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,30.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485587,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,30.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485588,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,20.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485589,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,60.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485590,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,30.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485591,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,60.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485592,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,20.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485593,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1,417.11282,[M+H]+,30.0,val,Cc1ccc(-c2cc3c(=O)[nH]nc(SCc4cc(=O)n5ccccc5n4)n3n2)cc1
485594,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485595,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485596,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,60.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485597,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,30.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485598,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485599,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,60.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485600,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,30.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485601,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,379.08233,[M-H]-,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485602,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485603,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485604,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,45.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485605,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,60.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485606,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485607,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,60.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485608,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,45.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485609,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3,381.09688,[M+H]+,20.0,val,COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
485610,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,403.05638,[M-H]-,20.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485611,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,403.05638,[M-H]-,60.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485612,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,403.05638,[M-H]-,20.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485613,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,403.05638,[M-H]-,45.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485614,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,439.03306,[M+Cl]-,20.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485615,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,439.03306,[M+Cl]-,20.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485616,Cc1c(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1,439.03306,[M+Cl]-,20.0,val,Cc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Br
485617,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485618,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485619,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485620,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,30.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485621,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485622,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,30.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485623,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485624,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,407.07388,[M-H]-,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485625,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,443.05056,[M+Cl]-,15.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485626,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,443.05056,[M+Cl]-,15.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485627,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,443.05056,[M+Cl]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485628,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485629,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485630,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485631,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,15.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485632,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485633,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485634,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,15.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485635,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,453.07936,[M+FA]-,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485636,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485637,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485638,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,45.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485639,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485640,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485641,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,60.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485642,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,45.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485643,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12,409.08844,[M+H]+,20.0,val,Nc1c(C(=O)NCCc2ccc(Cl)cc2)sc2nc(-c3ccncc3)ccc12
485644,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1,333.13977,[M+H]+,20.0,val,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1
485645,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1,333.13977,[M+H]+,20.0,val,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1
485646,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1,333.13977,[M+H]+,60.0,val,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1
485647,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1,333.13977,[M+H]+,30.0,val,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1
485648,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1,333.13977,[M+H]+,20.0,val,CC(=NNC(=O)c1cccc(F)c1)c1ccc(-c2ccccc2)cc1
485649,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,20.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485650,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,20.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485651,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,60.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485652,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,30.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485653,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,20.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485654,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,60.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485655,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,30.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485656,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1,333.13977,[M+H]+,20.0,val,Fc1ccc(OCc2nc3ccccc3n2Cc2ccccc2)cc1
485657,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485658,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485659,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485660,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,30.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485661,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485662,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,60.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485663,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,30.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485664,Cc1c(C)oc(-c2cc(NC(=O)c3c4ncccc4ccc3)ccc2)n1,344.13935,[M+H]+,20.0,val,Cc1nc(-c2cccc(NC(=O)c3cccc4cccnc34)c2)oc1C
485665,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485666,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485667,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485668,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485669,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485670,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485671,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485672,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,342.1248,[M-H]-,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485673,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,378.10148,[M+Cl]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485674,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,388.13028,[M+FA]-,15.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485675,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,388.13028,[M+FA]-,15.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485676,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,388.13028,[M+FA]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485677,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485678,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485679,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485680,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485681,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485682,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485683,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485684,c1cc(-c2nc3ccccc3[nH]2)cc(NCc2cc3c(cc2)OCO3)c1,344.13935,[M+H]+,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485685,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485686,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485687,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,60.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485688,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,15.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485689,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485690,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,15.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485691,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485692,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,342.1248,[M-H]-,60.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485693,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485694,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485695,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,45.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485696,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,60.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485697,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485698,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,45.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485699,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,60.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485700,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,342.1248,[M-H]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485701,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,378.10148,[M+Cl]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485702,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,378.10148,[M+Cl]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485703,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,378.10148,[M+Cl]-,60.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485704,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,378.10148,[M+Cl]-,15.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485705,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,378.10148,[M+Cl]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485706,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,388.13028,[M+FA]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485707,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,388.13028,[M+FA]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485708,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,388.13028,[M+FA]-,60.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485709,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,388.13028,[M+FA]-,15.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485710,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,388.13028,[M+FA]-,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485711,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485712,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485713,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,60.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485714,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485715,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,60.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485716,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,342.1248,[M-H]-,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485717,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485718,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485719,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485720,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485721,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485722,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485723,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,342.1248,[M-H]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485724,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,378.10148,[M+Cl]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485725,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,378.10148,[M+Cl]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485726,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,378.10148,[M+Cl]-,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485727,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,378.10148,[M+Cl]-,15.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485728,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,378.10148,[M+Cl]-,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485729,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,344.13935,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485730,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,344.13935,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485731,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,344.13935,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485732,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,344.13935,[M+H]+,20.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485733,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1,344.13935,[M+H]+,60.0,val,Cc1ccc(-c2cc(C(=O)O)c3c(-c4ccc(C)cc4)[nH]nc3n2)cc1
485734,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1,344.13935,[M+H]+,20.0,val,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1
485735,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1,344.13935,[M+H]+,20.0,val,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1
485736,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1,344.13935,[M+H]+,60.0,val,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1
485737,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1,344.13935,[M+H]+,30.0,val,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1
485738,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1,344.13935,[M+H]+,20.0,val,Cc1nc2cccc(C)n2c(=O)c1NC(=O)c1ccc2ccccc2c1
485739,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,344.13935,[M+H]+,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485740,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,344.13935,[M+H]+,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485741,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,344.13935,[M+H]+,60.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485742,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,344.13935,[M+H]+,30.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485743,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1,344.13935,[M+H]+,20.0,val,N#Cc1ccc2[nH]cc(CCCCN3C(=O)c4ccccc4C3=O)c2c1
485744,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485745,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485746,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,60.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485747,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485748,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,60.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485749,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1,344.13935,[M+H]+,20.0,val,Cc1cc(C)cc(C(=O)Nc2ccc(-c3nc4ncccc4o3)cc2)c1
485750,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485751,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485752,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485753,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485754,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485755,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,45.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485756,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,60.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485757,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1,344.13935,[M+H]+,20.0,val,c1cc(NCc2ccc3c(c2)OCO3)cc(-c2nc3ccccc3[nH]2)c1
485758,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cnccc1,376.11142,[M+H]+,20.0,val,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccnc1
485759,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cnccc1,376.11142,[M+H]+,20.0,val,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccnc1
485760,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cnccc1,376.11142,[M+H]+,60.0,val,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccnc1
485761,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cnccc1,376.11142,[M+H]+,20.0,val,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccnc1
485762,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cnccc1,376.11142,[M+H]+,45.0,val,Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccnc1
485763,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,374.09687,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485764,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,374.09687,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485765,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,374.09687,[M-H]-,60.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485766,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,374.09687,[M-H]-,15.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485767,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,374.09687,[M-H]-,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485768,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485769,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485770,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,60.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485771,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485772,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485773,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,20.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485774,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,30.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485775,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1,376.11142,[M+H]+,60.0,val,O=C(NCCNC(=O)c1cccc2ccccc12)c1nc2ccccc2s1
485776,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,454.05369,[M-H]-,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485777,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,454.05369,[M-H]-,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485778,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,454.05369,[M-H]-,60.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485779,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,454.05369,[M-H]-,30.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485780,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,454.05369,[M-H]-,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485781,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485782,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485783,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,60.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485784,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,15.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485785,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485786,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,60.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485787,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,15.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485788,CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc(-c2ccccc2)c1,456.06824,[M+H]+,20.0,val,CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)CSc1nnc(-c2ccco2)o1
485789,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,516.97679,[M+FA]-,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485790,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,516.97679,[M+FA]-,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485791,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,516.97679,[M+FA]-,60.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485792,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,516.97679,[M+FA]-,15.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485793,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,516.97679,[M+FA]-,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485794,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485795,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485796,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,60.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485797,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,30.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485798,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485799,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,30.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485800,OC(CNc1ccccc1)Cn1c2c(cc(Br)cc2)c2c1ccc(Br)c2,472.98586,[M+H]+,20.0,val,OC(CNc1ccccc1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21
485801,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,514.06114,[M+FA]-,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485802,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,514.06114,[M+FA]-,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485803,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,514.06114,[M+FA]-,60.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485804,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,514.06114,[M+FA]-,15.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485805,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,514.06114,[M+FA]-,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485806,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,470.07021,[M+H]+,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485807,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,470.07021,[M+H]+,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485808,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,470.07021,[M+H]+,60.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485809,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,470.07021,[M+H]+,15.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485810,O=C(c1cccs1)N(Cc1ccc(-c2cc(C(F)(F)F)ccc2)o1)C1CCS(=O)(=O)C1,470.07021,[M+H]+,20.0,val,O=C(c1cccs1)N(Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C1CCS(=O)(=O)C1
485811,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,470.09399,[M-H]-,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485812,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,470.09399,[M-H]-,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485813,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,470.09399,[M-H]-,60.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485814,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,470.09399,[M-H]-,30.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485815,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,470.09399,[M-H]-,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485816,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,472.10854,[M+H]+,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485817,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,472.10854,[M+H]+,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485818,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,472.10854,[M+H]+,60.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485819,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,472.10854,[M+H]+,30.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485820,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3c(cc(Oc4ncccn4)cc3)oc2=O)c1F,472.10854,[M+H]+,20.0,val,CNS(=O)(=O)Nc1nccc(Cc2c(C)c3ccc(Oc4ncccn4)cc3oc2=O)c1F
485821,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,455.09185,[M+FA]-,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485822,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,455.09185,[M+FA]-,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485823,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,455.09185,[M+FA]-,60.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485824,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,455.09185,[M+FA]-,15.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485825,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,455.09185,[M+FA]-,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485826,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,409.08637,[M-H]-,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485827,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,409.08637,[M-H]-,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485828,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,409.08637,[M-H]-,60.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485829,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,409.08637,[M-H]-,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485830,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,409.08637,[M-H]-,45.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485831,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485832,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485833,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,60.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485834,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,15.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485835,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485836,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,60.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485837,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,15.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485838,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,409.08637,[M-H]-,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485839,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,411.10092,[M+H]+,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485840,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,411.10092,[M+H]+,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485841,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,411.10092,[M+H]+,60.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485842,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,411.10092,[M+H]+,30.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485843,COc1cccc(-c2nnc(SCCOc3cc4c(cc3)c(C)cc(=O)o4)o2)c1,411.10092,[M+H]+,20.0,val,COc1cccc(-c2nnc(SCCOc3ccc4c(C)cc(=O)oc4c3)o2)c1
485844,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,411.10092,[M+H]+,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485845,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,411.10092,[M+H]+,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485846,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,411.10092,[M+H]+,60.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485847,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,411.10092,[M+H]+,15.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485848,COc1cc(NC(=S)NC(=O)c2ccccc2C)c(-c2ccc(C(=O)O)o2)cc1,411.10092,[M+H]+,20.0,val,COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(=O)c2ccccc2C)c1
485849,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485850,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485851,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,60.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485852,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,30.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485853,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485854,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,60.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485855,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,30.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485856,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cnccc1,411.10092,[M+H]+,20.0,val,COCCOC(=O)C1=C(N)Oc2c(c(=O)sc3ccccc23)C1c1cccnc1
485857,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485858,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485859,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,60.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485860,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,30.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485861,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485862,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,60.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485863,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,30.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485864,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,389.10777,[M-H]-,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485865,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485866,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485867,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,60.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485868,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485869,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,45.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485870,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,60.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485871,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1,391.12232,[M+H]+,20.0,val,CNc1nc(C)c(-c2nc3ccccc3c(=O)n2-c2ccc(C(C)=O)cc2)s1
485872,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1,391.12232,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
485873,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1,391.12232,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
485874,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1,391.12232,[M+H]+,45.0,val,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
485875,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1,391.12232,[M+H]+,60.0,val,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
485876,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1,391.12232,[M+H]+,20.0,val,O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
485877,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485878,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485879,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,60.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485880,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,15.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485881,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485882,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,60.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485883,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,15.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485884,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,405.10269,[M-H]-,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485885,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485886,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485887,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,30.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485888,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,60.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485889,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,15.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485890,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485891,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,60.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485892,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cn(-c2ccccc2)nc1,407.11724,[M+H]+,20.0,val,O=S(=O)(Nc1ccc(OCc2ccncc2)cc1)c1cnn(-c2ccccc2)c1
485893,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485894,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485895,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485896,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,30.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485897,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485898,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,30.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485899,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,60.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485900,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O,407.11724,[M+H]+,20.0,val,Cc1nc(-c2ccccc2)sc1C(=O)NCCn1nc(-c2ccco2)ccc1=O
485901,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12,407.11724,[M+H]+,20.0,val,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12
485902,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12,407.11724,[M+H]+,20.0,val,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12
485903,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12,407.11724,[M+H]+,60.0,val,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12
485904,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12,407.11724,[M+H]+,30.0,val,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12
485905,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12,407.11724,[M+H]+,20.0,val,Cc1cc2nnc(SCC(=O)Nc3ccc4c(c3)OCCO4)n2c2ccccc12
485906,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,581.96776,[M-H]-,15.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485907,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,581.96776,[M-H]-,15.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485908,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,581.96776,[M-H]-,20.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485909,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,581.96776,[M-H]-,60.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485910,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,581.96776,[M-H]-,15.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485911,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,583.98231,[M+H]+,20.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485912,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,583.98231,[M+H]+,20.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485913,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,583.98231,[M+H]+,60.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485914,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,583.98231,[M+H]+,30.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485915,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3c(Cl)cc(Br)cc3)cc2)n1,583.98231,[M+H]+,20.0,val,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)COc3ccc(Br)cc3Cl)cc2)n1
485916,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,20.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485917,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,20.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485918,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,45.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485919,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,60.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485920,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,20.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485921,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,45.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485922,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,60.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485923,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,423.0815,[M+H]+,20.0,val,O=C(c1ccc(Br)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1
485924,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,442.0843,[M-H]-,20.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485925,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,442.0843,[M-H]-,20.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485926,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,442.0843,[M-H]-,60.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485927,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,442.0843,[M-H]-,15.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485928,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,442.0843,[M-H]-,20.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485929,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,444.09886,[M+H]+,45.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485930,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,444.09886,[M+H]+,45.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485931,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,444.09886,[M+H]+,20.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485932,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,444.09886,[M+H]+,60.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485933,C[C@@H](Oc1cc2c(cc1)[nH]nc2/C=C/c1cn(CCO)nc1)c1c(Cl)cncc1Cl,444.09886,[M+H]+,45.0,val,C[C@@H](Oc1ccc2[nH]nc(/C=C/c3cnn(CCO)c3)c2c1)c1c(Cl)cncc1Cl
485934,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485935,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485936,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485937,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,30.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485938,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485939,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485940,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,30.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485941,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,399.14382,[M-H]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485942,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,435.1205,[M+Cl]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485943,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,435.1205,[M+Cl]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485944,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,435.1205,[M+Cl]-,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485945,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,435.1205,[M+Cl]-,15.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485946,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,435.1205,[M+Cl]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485947,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,445.1493,[M+FA]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485948,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,445.1493,[M+FA]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485949,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,445.1493,[M+FA]-,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485950,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,445.1493,[M+FA]-,15.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485951,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,445.1493,[M+FA]-,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485952,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485953,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485954,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485955,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,30.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485956,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485957,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,60.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485958,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,30.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485959,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1,401.15837,[M+H]+,20.0,val,Cc1nc(C(NC(=O)C2CC2c2ccc(C(F)(F)F)cc2)c2ccccc2)n[nH]1
485960,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485961,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485962,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,60.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485963,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,30.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485964,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485965,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485966,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,30.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485967,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,415.13873,[M-H]-,60.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485968,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,451.11541,[M+Cl]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485969,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,451.11541,[M+Cl]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485970,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,451.11541,[M+Cl]-,15.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485971,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,451.11541,[M+Cl]-,15.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485972,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,461.14421,[M+FA]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485973,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,461.14421,[M+FA]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485974,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,461.14421,[M+FA]-,60.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485975,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,461.14421,[M+FA]-,15.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485976,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,461.14421,[M+FA]-,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485977,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,45.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485978,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,45.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485979,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,45.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485980,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485981,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485982,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485983,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,45.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485984,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1,417.15329,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCn3nc(-c4ccc(C(F)(F)F)cc4)cc3C2)cn1
485985,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,417.15329,[M+H]+,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485986,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,417.15329,[M+H]+,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485987,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,417.15329,[M+H]+,60.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485988,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,417.15329,[M+H]+,20.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485989,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1,417.15329,[M+H]+,60.0,val,O=C(NC1(c2nc(-c3ccncc3)no2)CCCCC1)c1ccc(C(F)(F)F)cc1
485990,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,20.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485991,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,20.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485992,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,45.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485993,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,60.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485994,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,20.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485995,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,60.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485996,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1,417.15329,[M+H]+,20.0,val,COc1ccc2nccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cn4)CC3)c2c1
485997,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1,433.1482,[M+H]+,45.0,val,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1
485998,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1,433.1482,[M+H]+,45.0,val,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1
485999,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1,433.1482,[M+H]+,45.0,val,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1
486000,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1,433.1482,[M+H]+,60.0,val,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1
486001,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1,433.1482,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)N1CC2CN(c3ccc(C(F)(F)F)cn3)CC2C1
486002,Cn1cc(-c2cc(C(F)(F)F)c(F)cc2)nc1C1CCN(c2c3cn[nH]c3ncn2)CC1,446.17108,[M+H]+,20.0,val,Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc3[nH]ncc23)CC1
486003,Cn1cc(-c2cc(C(F)(F)F)c(F)cc2)nc1C1CCN(c2c3cn[nH]c3ncn2)CC1,446.17108,[M+H]+,20.0,val,Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc3[nH]ncc23)CC1
486004,Cn1cc(-c2cc(C(F)(F)F)c(F)cc2)nc1C1CCN(c2c3cn[nH]c3ncn2)CC1,446.17108,[M+H]+,60.0,val,Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc3[nH]ncc23)CC1
486005,Cn1cc(-c2cc(C(F)(F)F)c(F)cc2)nc1C1CCN(c2c3cn[nH]c3ncn2)CC1,446.17108,[M+H]+,20.0,val,Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc3[nH]ncc23)CC1
486006,Cn1cc(-c2cc(C(F)(F)F)c(F)cc2)nc1C1CCN(c2c3cn[nH]c3ncn2)CC1,446.17108,[M+H]+,60.0,val,Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc3[nH]ncc23)CC1
486007,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,397.10277,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486008,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,397.10277,[M-H]-,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486009,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,397.10277,[M-H]-,60.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486010,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,397.10277,[M-H]-,15.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486011,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486012,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486013,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486014,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486015,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486016,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,60.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486017,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,30.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486018,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1,399.11732,[M+H]+,20.0,val,Cc1ccc(S(=O)(=O)N/N=C/c2ccc(OCc3ccccc3F)cc2)cc1
486019,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486020,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486021,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,60.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486022,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,30.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486023,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486024,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,60.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486025,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,30.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486026,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,440.07442,[M-H]-,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486027,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,442.08897,[M+H]+,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486028,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,442.08897,[M+H]+,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486029,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,442.08897,[M+H]+,60.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486030,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,442.08897,[M+H]+,15.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486031,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O,442.08897,[M+H]+,20.0,val,COc1cccc(CNc2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2)c1O
486032,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486033,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486034,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,45.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486035,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,60.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486036,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486037,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,45.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486038,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,60.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486039,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,440.07442,[M-H]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486040,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,476.0511,[M+Cl]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486041,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,476.0511,[M+Cl]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486042,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,476.0511,[M+Cl]-,15.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486043,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,476.0511,[M+Cl]-,60.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486044,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,476.0511,[M+Cl]-,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486045,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486046,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486047,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,60.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486048,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,30.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486049,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486050,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,30.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486051,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,60.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486052,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1,442.08897,[M+H]+,20.0,val,Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)c1
486053,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486054,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486055,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486056,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486057,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486058,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486059,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486060,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,340.15677,[M-H]-,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486061,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486062,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486063,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486064,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486065,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486066,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486067,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486068,CCCc1c(C#N)c2nc3ccccc3n2c(NCc2cnccc2)c1,342.17132,[M+H]+,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486069,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,340.15677,[M-H]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486070,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,340.15677,[M-H]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486071,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,340.15677,[M-H]-,45.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486072,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,340.15677,[M-H]-,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486073,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,340.15677,[M-H]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486074,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,376.13345,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486075,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,376.13345,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486076,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,376.13345,[M+Cl]-,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486077,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,376.13345,[M+Cl]-,15.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486078,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,376.13345,[M+Cl]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486079,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,386.16225,[M+FA]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486080,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,386.16225,[M+FA]-,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486081,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,386.16225,[M+FA]-,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486082,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486083,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486084,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486085,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486086,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486087,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486088,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486089,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,340.15677,[M-H]-,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486090,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,323.15294,[M-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486091,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,323.15294,[M-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486092,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,323.15294,[M-H2O]+,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486093,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,323.15294,[M-H2O]+,30.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486094,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,323.15294,[M-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486095,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486096,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486097,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,15.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486098,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486099,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,30.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486100,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486101,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486102,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,324.16076,[M+H-H2O]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486103,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486104,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486105,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486106,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486107,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,60.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486108,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1,342.17132,[M+H]+,20.0,val,Cc1nccn1-c1cc(NC(c2ccccc2)c2ccccc2)ncn1
486109,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486110,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486111,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486112,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486113,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486114,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,60.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486115,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,45.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486116,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N,342.17132,[M+H]+,20.0,val,CCCc1cc(NCc2cccnc2)n2c(nc3ccccc32)c1C#N
486117,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,348.10637,[M-H]-,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486118,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,348.10637,[M-H]-,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486119,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,348.10637,[M-H]-,60.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486120,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,348.10637,[M-H]-,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486121,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,348.10637,[M-H]-,60.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486122,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,350.12093,[M+H]+,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486123,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,350.12093,[M+H]+,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486124,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,350.12093,[M+H]+,60.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486125,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,350.12093,[M+H]+,30.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486126,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1,350.12093,[M+H]+,20.0,val,Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)Cc2ccccc2-3)c1
486127,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,380.11396,[M-H]-,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486128,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,380.11396,[M-H]-,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486129,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,380.11396,[M-H]-,60.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486130,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,380.11396,[M-H]-,15.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486131,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,380.11396,[M-H]-,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486132,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,382.12851,[M+H]+,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486133,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,382.12851,[M+H]+,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486134,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,382.12851,[M+H]+,15.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486135,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,382.12851,[M+H]+,60.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486136,O=C(O)c1c(O)ccc(N(Cc2ccccc2O)Cc2c(O)ccc(O)c2)c1,382.12851,[M+H]+,20.0,val,O=C(O)c1cc(N(Cc2ccccc2O)Cc2cc(O)ccc2O)ccc1O
486137,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486138,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486139,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,60.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486140,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,30.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486141,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486142,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,60.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486143,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,30.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486144,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,380.11396,[M-H]-,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486145,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,382.12851,[M+H]+,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486146,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,382.12851,[M+H]+,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486147,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,382.12851,[M+H]+,60.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486148,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,382.12851,[M+H]+,15.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486149,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2c1ccc(O)c2,382.12851,[M+H]+,20.0,val,Cc1c(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c(=O)oc2cc(O)ccc12
486150,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,20.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486151,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,20.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486152,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,60.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486153,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,15.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486154,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,20.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486155,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,60.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486156,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,15.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486157,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1,382.12851,[M+H]+,20.0,val,CCOc1ccc(CC(=O)OCc2cc(-c3ccc4c(c3)OCO4)on2)cc1
486158,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12,382.12851,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12
486159,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12,382.12851,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12
486160,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12,382.12851,[M+H]+,60.0,val,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12
486161,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12,382.12851,[M+H]+,15.0,val,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12
486162,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12,382.12851,[M+H]+,20.0,val,COc1cccc2cc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)c(=O)oc12
486163,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,490.08451,[M+FA]-,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486164,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,490.08451,[M+FA]-,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486165,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,490.08451,[M+FA]-,60.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486166,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,490.08451,[M+FA]-,15.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486167,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,490.08451,[M+FA]-,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486168,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486169,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486170,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,60.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486171,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,30.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486172,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486173,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,30.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486174,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,20.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486175,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O,446.09358,[M+H]+,60.0,val,CC1CS(=O)(=O)N(c2ccc(C(=O)NCCc3c[nH]c4ccccc34)c(Cl)c2)C1=O
486176,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12,446.09358,[M+H]+,20.0,val,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12
486177,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12,446.09358,[M+H]+,20.0,val,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12
486178,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12,446.09358,[M+H]+,45.0,val,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12
486179,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12,446.09358,[M+H]+,60.0,val,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12
486180,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12,446.09358,[M+H]+,20.0,val,COc1ccc(Cl)c2sc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc12
486181,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1,354.12553,[M+H]+,20.0,val,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1
486182,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1,354.12553,[M+H]+,20.0,val,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1
486183,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1,354.12553,[M+H]+,60.0,val,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1
486184,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1,354.12553,[M+H]+,60.0,val,CCCC(C(=O)O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1
486185,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,578.07568,[M+Cl]-,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486186,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,578.07568,[M+Cl]-,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486187,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,578.07568,[M+Cl]-,15.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486188,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,578.07568,[M+Cl]-,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486189,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,544.11355,[M+H]+,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486190,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,544.11355,[M+H]+,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486191,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,544.11355,[M+H]+,60.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486192,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,544.11355,[M+H]+,30.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486193,C[C@H](Oc1c(C(=O)N2CCN(c3c(F)cc(C(F)(F)F)cn3)CC2)cc(S(C)(=O)=O)cc1)C(F)(F)F,544.11355,[M+H]+,20.0,val,C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1)C(F)(F)F
486194,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,411.08426,[M-H]-,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486195,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,411.08426,[M-H]-,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486196,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,411.08426,[M-H]-,60.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486197,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,411.08426,[M-H]-,30.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486198,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,411.08426,[M-H]-,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486199,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486200,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486201,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,60.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486202,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,15.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486203,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486204,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,60.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486205,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,20.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486206,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1,413.09881,[M+H]+,15.0,val,CN(c1ccsc1C(=O)Nc1ccc2c(c1)CCC2)S(=O)(=O)c1ccccc1
486207,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,407.11834,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486208,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,407.11834,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486209,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,407.11834,[M-H]-,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486210,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,407.11834,[M-H]-,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486211,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,407.11834,[M-H]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486212,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,453.12381,[M+FA]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486213,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,453.12381,[M+FA]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486214,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,453.12381,[M+FA]-,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486215,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,453.12381,[M+FA]-,15.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486216,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,453.12381,[M+FA]-,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486217,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,20.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486218,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,20.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486219,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,60.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486220,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,30.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486221,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,20.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486222,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,60.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486223,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,30.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486224,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3,409.13289,[M+H]+,20.0,val,CN(C)CCN(C(=O)c1ccc(C#N)cc1)c1nc2cc3c(cc2s1)OCCO3
486225,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,20.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486226,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,20.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486227,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,60.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486228,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,30.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486229,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,20.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486230,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,60.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486231,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,30.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486232,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC,409.13289,[M+H]+,20.0,val,CCOc1ccc(-c2noc(CSc3nccn3-c3ccccc3)n2)cc1OC
486233,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486234,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486235,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486236,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486237,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486238,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,60.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486239,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,30.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486240,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1,409.13289,[M+H]+,20.0,val,O=C(Cn1c(=O)oc2ccccc21)NCCn1nc(-c2cccs2)cc1C1CC1
486241,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486242,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486243,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486244,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486245,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,45.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486246,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486247,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486248,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,387.1575,[M-H]-,45.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486249,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,423.13418,[M+Cl]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486250,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,423.13418,[M+Cl]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486251,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,423.13418,[M+Cl]-,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486252,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,423.13418,[M+Cl]-,15.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486253,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,423.13418,[M+Cl]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486254,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,433.16298,[M+FA]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486255,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,433.16298,[M+FA]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486256,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,433.16298,[M+FA]-,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486257,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,433.16298,[M+FA]-,15.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486258,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,433.16298,[M+FA]-,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486259,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486260,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486261,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486262,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486263,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,60.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486264,O=C(Nc1cc2c(cc1)nc(N1CCOCC1)[nH]2)c1c(-c2ccccc2)[nH]nc1,389.17205,[M+H]+,20.0,val,O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1cn[nH]c1-c1ccccc1
486265,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,20.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486266,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,20.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486267,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,60.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486268,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,30.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486269,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,20.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486270,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,60.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486271,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,30.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486272,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1,389.17205,[M+H]+,20.0,val,O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1
486273,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486274,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486275,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,30.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486276,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486277,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486278,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,45.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486279,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486280,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,387.1575,[M-H]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486281,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,423.13418,[M+Cl]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486282,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,423.13418,[M+Cl]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486283,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,423.13418,[M+Cl]-,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486284,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,423.13418,[M+Cl]-,15.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486285,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,423.13418,[M+Cl]-,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486286,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486287,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486288,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,15.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486289,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486290,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,30.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486291,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486292,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,20.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486293,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1,389.17205,[M+H]+,60.0,val,O=C(CCCc1nc(=O)c2ccccc2[nH]1)Nc1ccc(Cn2cncn2)cc1
486294,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,419.14733,[M-H]-,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486295,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,419.14733,[M-H]-,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486296,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,419.14733,[M-H]-,60.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486297,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,419.14733,[M-H]-,30.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486298,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,419.14733,[M-H]-,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486299,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,421.16188,[M+H]+,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486300,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,421.16188,[M+H]+,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486301,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,421.16188,[M+H]+,60.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486302,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,421.16188,[M+H]+,30.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486303,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1,421.16188,[M+H]+,20.0,val,Cn1nnc(-c2ccc(OCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2)n1
486304,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,447.09329,[M-H]-,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486305,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,447.09329,[M-H]-,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
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486325,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,447.09329,[M-H]-,20.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
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486340,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.09329,[M-H]-,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
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486350,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
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486356,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486357,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486358,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,15.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486359,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486360,C[C@@H]1O[C@@H](Oc2c(O)c3c(c(O)c2)c(=O)c(O)c(-c2ccc(O)cc2)o3)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2O)[C@H](O)[C@H](O)[C@H]1O
486361,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486362,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486363,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486364,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,15.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486365,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486366,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,20.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486367,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,20.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486368,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,60.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486369,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,20.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486370,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,45.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486371,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,60.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486372,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,20.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486373,C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,471.08978,[M+Na]+,45.0,val,C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
486374,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486375,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486376,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486377,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486378,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486379,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486380,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486381,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c(O)c2,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12
486382,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,447.09329,[M-H]-,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486383,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,447.09329,[M-H]-,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486384,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,447.09329,[M-H]-,60.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486385,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,447.09329,[M-H]-,30.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486386,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,447.09329,[M-H]-,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486387,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486388,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486389,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486390,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486391,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,45.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486392,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486393,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486394,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,447.09329,[M-H]-,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486395,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486396,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,447.09329,[M-H]-,45.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486397,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,483.06996,[M+Cl]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486398,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,483.06996,[M+Cl]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486399,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,483.06996,[M+Cl]-,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486400,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,483.06996,[M+Cl]-,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486401,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,483.06996,[M+Cl]-,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486402,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486403,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486404,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,60.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486405,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,30.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486406,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
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486408,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,30.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
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486463,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486464,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486465,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486466,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,447.09329,[M-H]-,45.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486467,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486468,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486469,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486470,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486471,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486472,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486473,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486474,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486475,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486476,O=c1cc(-c2cc(O)c(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486477,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486478,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486479,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486480,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486481,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486482,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486483,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486484,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1OC(CO)C(O)C(O)C1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12
486485,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486486,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486487,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,60.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486488,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,30.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486489,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486490,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,60.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486491,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,30.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486492,COc1c(-c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2)oc2cc(O)cc(O)c2c1=O,449.10784,[M+H]+,20.0,val,COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O
486493,COc1c(O)ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2cc(O)c(O)cc2)C(=O)O)c1,466.13438,[M+NH4]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
486494,COc1c(O)ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2cc(O)c(O)cc2)C(=O)O)c1,466.13438,[M+NH4]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
486495,COc1c(O)ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2cc(O)c(O)cc2)C(=O)O)c1,466.13438,[M+NH4]+,60.0,val,COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
486496,COc1c(O)ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2cc(O)c(O)cc2)C(=O)O)c1,466.13438,[M+NH4]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
486497,COc1c(O)ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2cc(O)c(O)cc2)C(=O)O)c1,466.13438,[M+NH4]+,45.0,val,COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
486498,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486499,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486500,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486501,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,15.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486502,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486503,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486504,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,15.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486505,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
486506,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486507,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486508,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486509,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486510,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486511,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486512,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486513,O=c1cc(-c2cc(O)c(O)cc2)oc2c1c(O)cc(O)c2C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c(C3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486514,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486515,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486516,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486517,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486518,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
486519,O=c1cc(-c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)oc2cc(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12
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486572,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486573,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486574,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486575,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12
486576,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486577,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486578,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486579,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,15.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486580,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486581,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,60.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486582,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,20.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486583,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,449.10784,[M+H]+,15.0,val,C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
486584,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486585,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486586,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486587,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486588,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486589,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,30.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486590,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,60.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486591,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,449.10784,[M+H]+,20.0,val,O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
486592,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486593,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486594,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,60.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486595,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,15.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486596,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486597,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486598,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486599,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,60.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486600,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,30.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486601,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486602,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486603,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486604,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,60.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486605,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,15.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486606,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,351.1238,[M-H]-,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486607,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486608,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486609,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,60.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486610,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,30.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486611,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486612,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,30.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486613,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,60.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486614,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1,353.13835,[M+H]+,20.0,val,C#CCOc1ccc(C(=O)c2ccc(OCCCCC(=O)O)cc2)cc1
486615,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486616,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486617,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,60.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486618,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,15.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486619,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486620,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,60.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486621,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,15.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486622,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486623,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,367.11871,[M-H]-,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486624,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,367.11871,[M-H]-,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486625,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,367.11871,[M-H]-,60.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486626,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,367.11871,[M-H]-,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486627,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,367.11871,[M-H]-,45.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486628,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486629,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486630,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486631,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486632,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,45.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486633,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486634,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486635,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,367.11871,[M-H]-,45.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486636,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,369.13326,[M+H]+,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486637,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,369.13326,[M+H]+,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486638,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,369.13326,[M+H]+,60.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486639,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,369.13326,[M+H]+,20.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486640,COc1c2cc(-c3c(O)cc(O)cc3)c(=O)oc2cc(O)c1CC=C(C)C,369.13326,[M+H]+,45.0,val,COc1c(CC=C(C)C)c(O)cc2oc(=O)c(-c3ccc(O)cc3O)cc12
486641,COc1ccc(-c2c(O)c(=O)c3c(o2)c2c(cc3O)OC(C)(C)CC2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c4c(cc(O)c3c(=O)c2O)OC(C)(C)CC4)cc1
486642,COc1ccc(-c2c(O)c(=O)c3c(o2)c2c(cc3O)OC(C)(C)CC2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c4c(cc(O)c3c(=O)c2O)OC(C)(C)CC4)cc1
486643,COc1ccc(-c2c(O)c(=O)c3c(o2)c2c(cc3O)OC(C)(C)CC2)cc1,369.13326,[M+H]+,60.0,val,COc1ccc(-c2oc3c4c(cc(O)c3c(=O)c2O)OC(C)(C)CC4)cc1
486644,COc1ccc(-c2c(O)c(=O)c3c(o2)c2c(cc3O)OC(C)(C)CC2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c4c(cc(O)c3c(=O)c2O)OC(C)(C)CC4)cc1
486645,COc1ccc(-c2c(O)c(=O)c3c(o2)c2c(cc3O)OC(C)(C)CC2)cc1,369.13326,[M+H]+,45.0,val,COc1ccc(-c2oc3c4c(cc(O)c3c(=O)c2O)OC(C)(C)CC4)cc1
486646,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486647,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486648,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,369.13326,[M+H]+,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486649,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,369.13326,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486650,COc1ccc(-c2c(O)c(=O)c3c(O)cc(O)c(CC=C(C)C)c3o2)cc1,369.13326,[M+H]+,45.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1
486651,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486652,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486653,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,15.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486654,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,60.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486655,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,30.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486656,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486657,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,60.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486658,COc1c(O)ccc(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486659,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486660,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486661,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,60.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486662,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,30.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486663,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,367.11871,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486664,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486665,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486666,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,60.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486667,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,30.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486668,COc1c(O)ccc(/C=C/C(=O)/C=C(O)/C=C/c2cc(OC)c(O)cc2)c1,369.13326,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
486669,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486670,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486671,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,60.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486672,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,30.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486673,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486674,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,60.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486675,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,30.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486676,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,455.10625,[M-H]-,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486677,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,457.1208,[M+H]+,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486678,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,457.1208,[M+H]+,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486679,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,457.1208,[M+H]+,60.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486680,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,457.1208,[M+H]+,15.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486681,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2n[nH]nn2)s1,457.1208,[M+H]+,20.0,val,CCCCc1nc(Cl)c(C(=O)OC)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)s1
486682,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486683,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486684,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486685,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,30.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486686,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486687,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486688,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,30.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486689,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,405.14315,[M-H]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486690,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,441.11983,[M+Cl]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486691,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,441.11983,[M+Cl]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486692,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,441.11983,[M+Cl]-,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486693,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,441.11983,[M+Cl]-,15.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486694,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,441.11983,[M+Cl]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486695,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,451.14863,[M+FA]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486696,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,451.14863,[M+FA]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486697,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,451.14863,[M+FA]-,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486698,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,451.14863,[M+FA]-,15.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486699,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,451.14863,[M+FA]-,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486700,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486701,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486702,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486703,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,15.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486704,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486705,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,60.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486706,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,15.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486707,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,407.1577,[M+H]+,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486708,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21,429.13964,[M+Na]+,20.0,val,O=C(CCNC(=O)c1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCc2ccccc21
486709,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1,407.1577,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1
486710,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1,407.1577,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1
486711,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1,407.1577,[M+H]+,60.0,val,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1
486712,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1,407.1577,[M+H]+,15.0,val,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1
486713,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1,407.1577,[M+H]+,20.0,val,CCOc1ccccc1C(=O)N(CN1CCCC1=O)c1cccc(C(F)(F)F)c1
486714,COc1c(S(C)(=O)=O)ccc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)c1,417.12788,[M+H]+,20.0,val,COc1cc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)ccc1S(C)(=O)=O
486715,COc1c(S(C)(=O)=O)ccc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)c1,417.12788,[M+H]+,20.0,val,COc1cc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)ccc1S(C)(=O)=O
486716,COc1c(S(C)(=O)=O)ccc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)c1,417.12788,[M+H]+,60.0,val,COc1cc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)ccc1S(C)(=O)=O
486717,COc1c(S(C)(=O)=O)ccc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)c1,417.12788,[M+H]+,30.0,val,COc1cc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)ccc1S(C)(=O)=O
486718,COc1c(S(C)(=O)=O)ccc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)c1,417.12788,[M+H]+,20.0,val,COc1cc(Cc2noc(C3(Cc4ccccc4F)CC3)n2)ccc1S(C)(=O)=O
486719,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486720,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486721,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486722,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486723,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486724,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,415.11333,[M-H]-,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486725,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,415.11333,[M-H]-,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486726,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,415.11333,[M-H]-,60.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486727,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,415.11333,[M-H]-,30.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486728,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,415.11333,[M-H]-,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486729,CN(C1CCc2c(C1)c1ccccc1n2CC(=O)O)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,30.0,val,CN(C1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
486730,CN(C1CCc2c(C1)c1ccccc1n2CC(=O)O)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,30.0,val,CN(C1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
486731,CN(C1CCc2c(C1)c1ccccc1n2CC(=O)O)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,60.0,val,CN(C1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
486732,CN(C1CCc2c(C1)c1ccccc1n2CC(=O)O)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,20.0,val,CN(C1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
486733,CN(C1CCc2c(C1)c1ccccc1n2CC(=O)O)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,30.0,val,CN(C1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
486734,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486735,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486736,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,60.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486737,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,30.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486738,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1,417.12788,[M+H]+,20.0,val,CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1
486739,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486740,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486741,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486742,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486743,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486744,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486745,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486746,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486747,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486748,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486749,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486750,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486751,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,415.11333,[M-H]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486752,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,451.09001,[M+Cl]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486753,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,451.09001,[M+Cl]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486754,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,451.09001,[M+Cl]-,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486755,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,451.09001,[M+Cl]-,15.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486756,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,451.09001,[M+Cl]-,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486757,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486758,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486759,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486760,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486761,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486762,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,60.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486763,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,30.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486764,O=C(O)CCn1c2c(C[C@H](NS(=O)(=O)c3ccc(F)cc3)CC2)c2ccccc21,417.12788,[M+H]+,20.0,val,O=C(O)CCn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
486765,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486766,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486767,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,60.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486768,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,30.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486769,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486770,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,60.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486771,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,30.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486772,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,394.12309,[M-H]-,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486773,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486774,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486775,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,60.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486776,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,15.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486777,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486778,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,60.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486779,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,15.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486780,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,394.12309,[M-H]-,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486781,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,396.13764,[M+H]+,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486782,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,396.13764,[M+H]+,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486783,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,396.13764,[M+H]+,60.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486784,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,396.13764,[M+H]+,30.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486785,CCOC(=O)C1CCc2c1nc(NC(=O)C(c1ccccc1)n1cccc1)s2,396.13764,[M+H]+,20.0,val,CCOC(=O)C1CCc2sc(NC(=O)C(c3ccccc3)n3cccc3)nc21
486786,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,396.13764,[M+H]+,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486787,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,396.13764,[M+H]+,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486788,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,396.13764,[M+H]+,60.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486789,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,396.13764,[M+H]+,30.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486790,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S,396.13764,[M+H]+,20.0,val,CC/C(CC(c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=S
486791,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,20.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486792,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,20.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486793,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,60.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486794,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,20.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486795,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,45.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486796,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,60.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486797,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,20.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486798,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12,396.13764,[M+H]+,45.0,val,COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccn2)nc2ccccc12
486799,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,440.12857,[M+FA]-,20.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486800,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,440.12857,[M+FA]-,15.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486801,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,440.12857,[M+FA]-,60.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486802,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486803,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486804,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,60.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486805,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,30.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486806,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486807,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,60.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486808,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,30.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486809,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCCn3nc(C)c(-c4ccsc4)c3C)oc12
486810,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486811,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486812,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,60.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486813,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,30.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486814,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486815,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,60.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486816,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,30.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486817,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12,396.13764,[M+H]+,20.0,val,COc1cccc2cc(C(=O)NCC(c3ccsc3)n3nc(C)cc3C)oc12
486818,COC(=O)c1ccccc1NC(=O)CSc1nc2c(cc1C#N)CCCCC2,396.13764,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(cc1C#N)CCCCC2
486819,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,20.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486820,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,20.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486821,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,60.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486822,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,30.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486823,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,20.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486824,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,30.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486825,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,60.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486826,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C,396.13764,[M+H]+,20.0,val,Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc3c(c2)OCCO3)c1C
486827,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,20.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486828,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,20.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486829,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,60.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486830,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,15.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486831,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,20.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486832,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,60.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486833,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,20.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486834,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O,396.13764,[M+H]+,15.0,val,COc1ccccc1-n1ccnc(SCC(=O)Nc2cc(C)ccc2C)c1=O
486835,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,20.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486836,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,20.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486837,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,30.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486838,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,60.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486839,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,15.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486840,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,20.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486841,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,60.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486842,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21,396.13764,[M+H]+,20.0,val,O=C1NCCCn2cc(S(=O)(=O)N(Cc3ccccc3)c3ccccc3)cc21
486843,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486844,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486845,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486846,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,30.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486847,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486848,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486849,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,30.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486850,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,394.14085,[M-H]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486851,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,430.11752,[M+Cl]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486852,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,430.11752,[M+Cl]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486853,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,430.11752,[M+Cl]-,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486854,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,430.11752,[M+Cl]-,15.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486855,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,430.11752,[M+Cl]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486856,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,440.14632,[M+FA]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486857,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,440.14632,[M+FA]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486858,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,440.14632,[M+FA]-,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486859,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,440.14632,[M+FA]-,15.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486860,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,440.14632,[M+FA]-,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486861,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486862,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486863,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486864,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,30.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486865,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486866,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,60.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486867,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,30.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486868,O=C(Nc1cc2c(CCOC2)nc1)C1CC(=O)N(c2cc3c(cc2)OCCO3)C1,396.1554,[M+H]+,20.0,val,O=C(Nc1cnc2c(c1)COCC2)C1CC(=O)N(c2ccc3c(c2)OCCO3)C1
486869,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486870,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486871,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,60.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486872,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,30.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486873,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486874,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,60.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486875,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,30.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486876,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,394.14085,[M-H]-,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486877,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486878,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486879,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486880,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,30.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486881,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486882,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486883,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,30.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486884,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,394.14085,[M-H]-,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486885,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,394.14085,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486886,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,394.14085,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486887,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,394.14085,[M-H]-,60.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486888,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,394.14085,[M-H]-,15.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486889,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,394.14085,[M-H]-,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486890,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486891,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486892,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,60.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486893,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,15.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486894,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486895,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,60.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486896,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,15.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486897,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O,396.1554,[M+H]+,20.0,val,CC(C)[C@@H](C(=O)N[C@H](C(=O)O)c1ccccc1)n1c(=O)[nH]c2ccccc2c1=O
486898,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486899,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486900,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486901,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,15.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486902,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486903,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,60.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486904,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,15.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486905,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O,396.1554,[M+H]+,20.0,val,O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N[C@@H](Cc1ccccc1)C(=O)O
486906,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,396.1554,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486907,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,396.1554,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486908,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,396.1554,[M+H]+,60.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486909,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,396.1554,[M+H]+,15.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486910,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC,396.1554,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC
486911,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486912,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486913,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,60.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486914,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,30.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486915,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486916,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486917,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,30.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486918,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,394.14085,[M-H]-,60.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486919,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,440.14632,[M+FA]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486920,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,440.14632,[M+FA]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486921,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,440.14632,[M+FA]-,60.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486922,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,440.14632,[M+FA]-,15.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486923,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,440.14632,[M+FA]-,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486924,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486925,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486926,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,60.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486927,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,30.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486928,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486929,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,60.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486930,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,30.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486931,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1,396.1554,[M+H]+,20.0,val,COc1cc(NC(=O)c2nn(-c3ccc(C)cc3)c(=O)cc2OC)cc(OC)c1
486932,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486933,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486934,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486935,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,30.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486936,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486937,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,60.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486938,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,30.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486939,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1,396.1554,[M+H]+,20.0,val,O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCOCC2=O)cc1
486940,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21,388.18803,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21
486941,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21,388.18803,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21
486942,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21,388.18803,[M+H]+,60.0,val,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21
486943,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21,388.18803,[M+H]+,30.0,val,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21
486944,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21,388.18803,[M+H]+,20.0,val,O=C(c1ccc(N2CCN(c3ncccn3)CC2)nn1)N1CCc2ccccc21
486945,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,60.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486946,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,60.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486947,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,20.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486948,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,60.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486949,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,45.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486950,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,20.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486951,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1,404.18295,[M+H]+,60.0,val,CCc1cc(-c2nc(-c3cnc4cnccn34)no2)c2c(CC(C)(C)C)noc2n1
486952,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,438.14507,[M+Cl]-,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486953,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,438.14507,[M+Cl]-,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486954,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,438.14507,[M+Cl]-,60.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486955,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,438.14507,[M+Cl]-,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486956,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486957,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486958,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,45.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486959,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,60.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486960,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486961,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,60.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486962,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,45.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486963,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1,404.18295,[M+H]+,20.0,val,Cc1nnc(-c2ccc3ccn(CC(=O)N4CCN(c5ncccn5)CC4)c3c2)o1
486964,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486965,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486966,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,45.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486967,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,60.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486968,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486969,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,45.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486970,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,60.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486971,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,398.10677,[M-H]-,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486972,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486973,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486974,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,60.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486975,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,30.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486976,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486977,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,60.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486978,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,30.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486979,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1,400.12132,[M+H]+,20.0,val,COc1cccc(C2C(C(=O)c3cccs3)=C(O)C(=O)N2CC2CCCO2)c1
486980,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486981,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486982,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,60.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486983,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486984,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,45.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486985,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,60.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486986,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486987,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,398.12769,[M-H]-,45.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486988,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,444.13317,[M+FA]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486989,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,444.13317,[M+FA]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486990,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,444.13317,[M+FA]-,60.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486991,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,444.13317,[M+FA]-,15.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486992,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,444.13317,[M+FA]-,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486993,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,400.14225,[M+H]+,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486994,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,400.14225,[M+H]+,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486995,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,400.14225,[M+H]+,60.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486996,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,400.14225,[M+H]+,30.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486997,Cn1c(=O)[nH]c2c1cc(C(=O)NCC1(c3ccccc3Cl)CCOCC1)cc2,400.14225,[M+H]+,20.0,val,Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21
486998,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,398.12769,[M-H]-,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
486999,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,398.12769,[M-H]-,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487000,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,398.12769,[M-H]-,60.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487001,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,398.12769,[M-H]-,30.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487002,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,398.12769,[M-H]-,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487003,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487004,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487005,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,30.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487006,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,60.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487007,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,15.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487008,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487009,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,60.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487010,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2c(N3)c(Cl)ccc2)cc1,400.14225,[M+H]+,20.0,val,CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)c2cccc(Cl)c2N3)cc1
487011,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487012,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487013,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,60.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487014,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487015,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487016,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,60.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487017,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487018,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,445.16166,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1
487019,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487020,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487021,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,60.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487022,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,30.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487023,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487024,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,60.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487025,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,30.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487026,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,366.16233,[M-H]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487027,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,412.16781,[M+FA]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487028,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,412.16781,[M+FA]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487029,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,412.16781,[M+FA]-,60.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487030,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,412.16781,[M+FA]-,15.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487031,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,412.16781,[M+FA]-,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487032,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487033,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487034,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,60.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487035,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487036,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,45.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487037,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,60.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487038,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,20.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487039,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2c1ccc(F)c2,368.17688,[M+H]+,45.0,val,Cn1c(CNC(=O)C2(c3ccccc3)CCOCC2)nc2cc(F)ccc21
487040,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21,368.17688,[M+H]+,20.0,val,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21
487041,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21,368.17688,[M+H]+,20.0,val,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21
487042,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21,368.17688,[M+H]+,60.0,val,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21
487043,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21,368.17688,[M+H]+,30.0,val,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21
487044,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21,368.17688,[M+H]+,20.0,val,Cn1cc(CC(=O)N2CCC(COc3ccc(F)cn3)C2)c2ccccc21
487045,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,446.10139,[M-H]-,30.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487046,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,446.10139,[M-H]-,30.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487047,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,446.10139,[M-H]-,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487048,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,446.10139,[M-H]-,60.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487049,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,446.10139,[M-H]-,30.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487050,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487051,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487052,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,60.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487053,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,15.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487054,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487055,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487056,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,15.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487057,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,492.10686,[M+FA]-,60.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487058,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,448.11594,[M+H]+,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487059,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,448.11594,[M+H]+,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487060,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,448.11594,[M+H]+,60.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487061,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,448.11594,[M+H]+,30.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487062,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1,448.11594,[M+H]+,20.0,val,CC1=C(c2ccc(F)cc2)S(=O)(=O)N=C1N1CCCN(C(=O)Cc2ccsc2)CC1
487063,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2,388.13772,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2
487064,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2,388.13772,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2
487065,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2,388.13772,[M+H]+,60.0,val,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2
487066,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2,388.13772,[M+H]+,30.0,val,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2
487067,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2,388.13772,[M+H]+,20.0,val,O=C(Cc1ccc(F)cc1)N1C2CCC1CC(S(=O)(=O)c1ccccc1)C2
487068,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,20.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487069,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,20.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487070,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,60.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487071,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,20.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487072,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,45.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487073,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,60.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487074,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,20.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487075,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O,396.11988,[M]+,45.0,val,CCn1c(=Cc2cccc[n+]2CC)s/c(=C2/Sc3ccccc3N2C)c1=O
487076,N#Cc1c2CCCCc2c2CCCCc2c1NC(=O)CSc1ncccn1,379.15871,[M+H]+,20.0,val,N#Cc1c2c(c3c(c1NC(=O)CSc1ncccn1)CCCC3)CCCC2
487077,N#Cc1c2CCCCc2c2CCCCc2c1NC(=O)CSc1ncccn1,379.15871,[M+H]+,20.0,val,N#Cc1c2c(c3c(c1NC(=O)CSc1ncccn1)CCCC3)CCCC2
487078,N#Cc1c2CCCCc2c2CCCCc2c1NC(=O)CSc1ncccn1,379.15871,[M+H]+,60.0,val,N#Cc1c2c(c3c(c1NC(=O)CSc1ncccn1)CCCC3)CCCC2
487079,N#Cc1c2CCCCc2c2CCCCc2c1NC(=O)CSc1ncccn1,379.15871,[M+H]+,30.0,val,N#Cc1c2c(c3c(c1NC(=O)CSc1ncccn1)CCCC3)CCCC2
487080,N#Cc1c2CCCCc2c2CCCCc2c1NC(=O)CSc1ncccn1,379.15871,[M+H]+,20.0,val,N#Cc1c2c(c3c(c1NC(=O)CSc1ncccn1)CCCC3)CCCC2
487081,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487082,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487083,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,60.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487084,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,30.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487085,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487086,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487087,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487088,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,337.14453,[M-H]-,60.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487089,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487090,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,337.14453,[M-H]-,45.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487091,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487092,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487093,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,339.15909,[M+H]+,60.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487094,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,339.15909,[M+H]+,30.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487095,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1c(/C=C/C(=O)c2ccc(O)cc2)ccc(O)c1CC=C(C)C
487096,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487097,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487098,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,30.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487099,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,60.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487100,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487101,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,45.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487102,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,60.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487103,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487104,CC(C)=CCC/C(C)=C/COc1c2ccc(=O)oc2cc2c1cco2,339.15909,[M+H]+,30.0,val,CC(C)=CCC/C(C)=C/COc1c2ccoc2cc2oc(=O)ccc12
487105,CC(C)=CCC/C(C)=C/COc1c2ccc(=O)oc2cc2c1cco2,339.15909,[M+H]+,30.0,val,CC(C)=CCC/C(C)=C/COc1c2ccoc2cc2oc(=O)ccc12
487106,CC(C)=CCC/C(C)=C/COc1c2ccc(=O)oc2cc2c1cco2,339.15909,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2ccoc2cc2oc(=O)ccc12
487107,CC(C)=CCC/C(C)=C/COc1c2ccc(=O)oc2cc2c1cco2,339.15909,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/COc1c2ccoc2cc2oc(=O)ccc12
487108,CC(C)=CCC/C(C)=C/COc1c2ccc(=O)oc2cc2c1cco2,339.15909,[M+H]+,30.0,val,CC(C)=CCC/C(C)=C/COc1c2ccoc2cc2oc(=O)ccc12
487109,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,20.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487110,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,20.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487111,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,60.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487112,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,30.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487113,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,20.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487114,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,60.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487115,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,30.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487116,CCOc1c(OCC)c2c(cc1)c(C)c(Cc1ccccc1)c(=O)o2,339.15909,[M+H]+,20.0,val,CCOc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1OCC
487117,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487118,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487119,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,60.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487120,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,30.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487121,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,337.14453,[M-H]-,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487122,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487123,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487124,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487125,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487126,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,45.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487127,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487128,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487129,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,337.14453,[M-H]-,45.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487130,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,20.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487131,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,20.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487132,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,60.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487133,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,30.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487134,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,20.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487135,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,60.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487136,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,30.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487137,COc1c(CC=C(C)C)c(O)c(C(=O)O)c(/C=C/c2ccccc2)c1,337.14453,[M-H]-,20.0,val,COc1cc(/C=C/c2ccccc2)c(C(=O)O)c(O)c1CC=C(C)C
487138,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487139,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487140,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487141,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,30.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487142,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487143,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487144,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,30.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487145,C=CC(C)(C)c1c(O)cc(O)c(/C=C/C(=O)c2ccc(OC)cc2)c1,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(OC)cc2)c(O)cc1O
487146,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487147,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487148,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,30.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487149,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,60.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487150,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2,339.15909,[M+H]+,20.0,val,COc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
487151,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487152,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487153,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,45.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487154,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487155,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487156,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487157,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,45.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487158,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487159,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487160,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487161,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,30.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487162,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,60.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487163,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487164,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,45.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487165,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,60.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487166,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,337.14453,[M-H]-,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487167,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487168,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487169,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,45.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487170,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,60.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487171,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487172,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,60.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487173,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,45.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487174,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,337.14453,[M-H]-,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487175,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487176,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487177,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,60.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487178,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,30.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487179,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487180,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,60.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487181,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,30.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487182,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487183,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,339.15909,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487184,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,339.15909,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487185,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,339.15909,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487186,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,339.15909,[M+H]+,15.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487187,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,339.15909,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487188,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,356.18563,[M+NH4]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487189,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,356.18563,[M+NH4]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487190,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,356.18563,[M+NH4]+,60.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487191,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,356.18563,[M+NH4]+,15.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487192,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,356.18563,[M+NH4]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487193,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,361.14103,[M+Na]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487194,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,361.14103,[M+Na]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487195,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,361.14103,[M+Na]+,30.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487196,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12,361.14103,[M+Na]+,20.0,val,CC(C)=CCC/C(C)=C/COc1c2occc2cc2ccc(=O)oc12
487197,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487198,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487199,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487200,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,30.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487201,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487202,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,30.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487203,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,60.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487204,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O,339.15909,[M+H]+,20.0,val,C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
487205,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487206,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487207,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,60.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487208,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,30.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487209,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487210,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,60.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487211,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,30.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487212,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C,339.15909,[M+H]+,20.0,val,COc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1CC=C(C)C
487213,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,549.05612,[M-H]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487214,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,549.05612,[M-H]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487215,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,549.05612,[M-H]-,60.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487216,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,549.05612,[M-H]-,30.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487217,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,549.05612,[M-H]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487218,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,585.0328,[M+Cl]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487219,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,585.0328,[M+Cl]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487220,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,585.0328,[M+Cl]-,60.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487221,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,585.0328,[M+Cl]-,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487222,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,585.0328,[M+Cl]-,45.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487223,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,551.07068,[M+H]+,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487224,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,551.07068,[M+H]+,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487225,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,551.07068,[M+H]+,60.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487226,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,551.07068,[M+H]+,20.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487227,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2nn(Cc3cc(Br)ccc3)cc2)C[C@@H]1O,551.07068,[M+H]+,45.0,val,NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ncncc2C(=O)c2ccn(Cc3cccc(Br)c3)n2)C[C@@H]1O
487228,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,499.0598,[M-H]-,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487229,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,499.0598,[M-H]-,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487230,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,499.0598,[M-H]-,60.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487231,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,499.0598,[M-H]-,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487232,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,499.0598,[M-H]-,45.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487233,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,501.07435,[M+H]+,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487234,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,501.07435,[M+H]+,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487235,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,501.07435,[M+H]+,60.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487236,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,501.07435,[M+H]+,15.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487237,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1,501.07435,[M+H]+,20.0,val,O=C(Nc1ccc(CP(=O)(O)O)cc1)C1CCN(C(=O)OCc2cc(Cl)cc(Cl)c2)CC1
487238,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,401.1096,[M-H]-,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487239,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,401.1096,[M-H]-,60.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487240,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487241,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487242,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,60.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487243,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,15.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487244,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487245,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,15.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487246,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487247,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,447.11508,[M+FA]-,60.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487248,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,403.12415,[M+H]+,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487249,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,403.12415,[M+H]+,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487250,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,403.12415,[M+H]+,60.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487251,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,403.12415,[M+H]+,15.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487252,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1,403.12415,[M+H]+,20.0,val,CSc1ccc(CNC(=O)C2CCCN(C(=O)c3ccccc3Cl)C2)cc1
487253,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487254,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487255,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,60.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487256,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,30.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487257,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487258,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,30.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487259,CC(C)c1cc(C(C)C)c(O)c(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1,403.14191,[M+H]+,20.0,val,CC(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(O)c(C(C)C)c1
487260,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,421.13359,[M+Cl]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487261,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,421.13359,[M+Cl]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487262,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,421.13359,[M+Cl]-,15.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487263,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,421.13359,[M+Cl]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487264,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,431.16239,[M+FA]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487265,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,431.16239,[M+FA]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487266,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,431.16239,[M+FA]-,60.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487267,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,431.16239,[M+FA]-,15.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487268,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,431.16239,[M+FA]-,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487269,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,387.17146,[M+H]+,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487270,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,387.17146,[M+H]+,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487271,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,387.17146,[M+H]+,60.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487272,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,387.17146,[M+H]+,15.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487273,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,387.17146,[M+H]+,20.0,val,CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF
487274,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487275,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487276,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487277,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,30.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487278,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487279,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487280,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,30.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487281,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,433.1239,[M-H]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487282,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,469.10057,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487283,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,469.10057,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487284,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,469.10057,[M+Cl]-,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487285,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,469.10057,[M+Cl]-,15.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487286,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,469.10057,[M+Cl]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487287,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,479.12937,[M+FA]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487288,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,479.12937,[M+FA]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487289,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,479.12937,[M+FA]-,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487290,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,479.12937,[M+FA]-,15.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487291,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,479.12937,[M+FA]-,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487292,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487293,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487294,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487295,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,15.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487296,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487297,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,60.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487298,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,15.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487299,CCOC(=O)c1cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1,435.13845,[M+H]+,20.0,val,CCOC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1
487300,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,348.17175,[M-H]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487301,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,348.17175,[M-H]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487302,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,348.17175,[M-H]-,60.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487303,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,348.17175,[M-H]-,30.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487304,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,348.17175,[M-H]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487305,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,394.17723,[M+FA]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487306,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,394.17723,[M+FA]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487307,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,394.17723,[M+FA]-,60.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487308,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,394.17723,[M+FA]-,15.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487309,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,394.17723,[M+FA]-,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487310,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487311,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487312,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,60.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487313,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487314,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,45.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487315,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,60.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487316,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487317,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,348.17175,[M-H]-,45.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487318,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,394.17723,[M+FA]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487319,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,394.17723,[M+FA]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487320,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,394.17723,[M+FA]-,60.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487321,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,394.17723,[M+FA]-,15.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487322,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,394.17723,[M+FA]-,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487323,Cc1ccc(C(C)N(C)C(=O)NCc2noc(-c3ccccc3)c2)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(C(C)N(C)C(=O)NCc2cc(-c3ccccc3)on2)cc1
487324,Cc1ccc(C(C)N(C)C(=O)NCc2noc(-c3ccccc3)c2)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(C(C)N(C)C(=O)NCc2cc(-c3ccccc3)on2)cc1
487325,Cc1ccc(C(C)N(C)C(=O)NCc2noc(-c3ccccc3)c2)cc1,350.1863,[M+H]+,60.0,val,Cc1ccc(C(C)N(C)C(=O)NCc2cc(-c3ccccc3)on2)cc1
487326,Cc1ccc(C(C)N(C)C(=O)NCc2noc(-c3ccccc3)c2)cc1,350.1863,[M+H]+,15.0,val,Cc1ccc(C(C)N(C)C(=O)NCc2cc(-c3ccccc3)on2)cc1
487327,Cc1ccc(C(C)N(C)C(=O)NCc2noc(-c3ccccc3)c2)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(C(C)N(C)C(=O)NCc2cc(-c3ccccc3)on2)cc1
487328,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487329,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487330,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,60.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487331,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,30.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487332,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487333,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,60.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487334,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,30.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487335,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12,350.1863,[M+H]+,20.0,val,C[C@@H]1CC[C@H](O)CN1C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12
487336,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,350.1863,[M+H]+,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487337,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,350.1863,[M+H]+,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487338,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,350.1863,[M+H]+,60.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487339,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,350.1863,[M+H]+,15.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487340,O=C1Cc2c(ccc(CNC(=O)NC3CCCCc4ccccc43)c2)N1,350.1863,[M+H]+,20.0,val,O=C1Cc2cc(CNC(=O)NC3CCCCc4ccccc43)ccc2N1
487341,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,20.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487342,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,20.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487343,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,60.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487344,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,20.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487345,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,45.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487346,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,60.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487347,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,20.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487348,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2CCCn12,350.1863,[M+H]+,45.0,val,Cc1cc(=O)c(-c2noc(C(c3ccccc3)C(C)C)n2)c2n1CCC2
487349,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,20.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487350,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,20.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487351,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,30.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487352,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,60.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487353,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,15.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487354,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,20.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487355,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,60.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487356,CC1CCc2ccccc2N1C(=O)CNc1cc2c(cc1)CCNC2=O,350.1863,[M+H]+,20.0,val,CC1CCc2ccccc2N1C(=O)CNc1ccc2c(c1)C(=O)NCC2
487357,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,332.17574,[M+H-H2O]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487358,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,332.17574,[M+H-H2O]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487359,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,332.17574,[M+H-H2O]+,60.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487360,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,332.17574,[M+H-H2O]+,30.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487361,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,332.17574,[M+H-H2O]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487362,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487363,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487364,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,30.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487365,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,60.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487366,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,15.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487367,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487368,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,60.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487369,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1,350.1863,[M+H]+,20.0,val,Cc1noc(CN2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1
487370,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,20.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487371,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,20.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487372,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,60.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487373,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,30.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487374,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,20.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487375,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,60.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487376,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,30.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487377,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21,350.1863,[M+H]+,20.0,val,CCCCCCn1c(O)c(N=NC(=O)c2ccccc2)c2ccccc21
487378,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,20.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487379,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,20.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487380,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,60.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487381,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,30.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487382,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,20.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487383,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,60.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487384,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,30.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487385,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1,350.1863,[M+H]+,20.0,val,CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)cc1
487386,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487387,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487388,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487389,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,30.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487390,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487391,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487392,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,30.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487393,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,348.17175,[M-H]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487394,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,384.14843,[M+Cl]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487395,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,384.14843,[M+Cl]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487396,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,394.17723,[M+FA]-,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487397,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,394.17723,[M+FA]-,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487398,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,394.17723,[M+FA]-,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487399,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,394.17723,[M+FA]-,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487400,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,394.17723,[M+FA]-,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487401,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,349.17848,[M]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487402,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,349.17848,[M]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487403,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,349.17848,[M]+,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487404,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,349.17848,[M]+,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487405,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,349.17848,[M]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487406,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487407,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487408,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487409,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487410,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487411,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,60.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487412,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,15.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487413,Cc1c(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2ccccc2[nH]1,350.1863,[M+H]+,20.0,val,Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1
487414,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487415,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487416,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,60.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487417,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487418,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,45.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487419,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,60.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487420,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487421,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,20.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487422,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,20.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487423,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,30.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487424,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,60.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487425,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,20.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487426,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487427,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487428,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,45.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487429,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,60.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487430,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487431,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,60.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487432,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,45.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487433,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,348.17175,[M-H]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487434,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,384.14843,[M+Cl]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487435,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,394.17723,[M+FA]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487436,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,394.17723,[M+FA]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487437,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,394.17723,[M+FA]-,60.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487438,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,394.17723,[M+FA]-,15.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487439,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,394.17723,[M+FA]-,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487440,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,394.17723,[M+FA]-,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487441,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,394.17723,[M+FA]-,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487442,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,394.17723,[M+FA]-,60.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487443,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,394.17723,[M+FA]-,15.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487444,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,394.17723,[M+FA]-,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487445,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,348.17175,[M-H]-,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487446,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,348.17175,[M-H]-,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487447,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,348.17175,[M-H]-,60.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487448,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,348.17175,[M-H]-,30.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487449,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,348.17175,[M-H]-,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487450,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,394.17723,[M+FA]-,15.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487451,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,394.17723,[M+FA]-,15.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487452,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,394.17723,[M+FA]-,60.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487453,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,394.17723,[M+FA]-,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487454,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,394.17723,[M+FA]-,15.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487455,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487456,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487457,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,60.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487458,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,30.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487459,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487460,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,30.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487461,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,60.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487462,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1,350.1863,[M+H]+,20.0,val,Cc1ccc(N2CC(NC(=O)N3CCCc4ccccc43)CC2=O)cc1
487463,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487464,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487465,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,45.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487466,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,60.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487467,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487468,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,60.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487469,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,45.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487470,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1,350.1863,[M+H]+,20.0,val,CCOc1ccc(-n2ccnc(NCCCc3ccccc3)c2=O)cc1
487471,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1,350.1863,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1
487472,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1,350.1863,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1
487473,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1,350.1863,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1
487474,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1,350.1863,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1
487475,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1,350.1863,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)CC(C)(C)C)c1
487476,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,15.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487477,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,15.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487478,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,20.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487479,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,60.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487480,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1,350.1863,[M+H]+,15.0,val,CC(C)CCC(=O)Nc1ccccc1-c1nc(Cc2ccccc2)no1
487481,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1,350.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1
487482,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1,350.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1
487483,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1,350.1863,[M+H]+,45.0,val,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1
487484,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1,350.1863,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1
487485,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1,350.1863,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCc1ccc(-c2cnn(C)c2)cc1
487486,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1,350.1863,[M+H]+,20.0,val,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1
487487,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1,350.1863,[M+H]+,20.0,val,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1
487488,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1,350.1863,[M+H]+,60.0,val,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1
487489,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1,350.1863,[M+H]+,30.0,val,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1
487490,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1,350.1863,[M+H]+,20.0,val,Cc1cc(C)c2c(CN3CCN(c4ccccn4)CC3)cc(=O)oc2c1
487491,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,20.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487492,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,20.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487493,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,45.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487494,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,60.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487495,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,20.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487496,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,60.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487497,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,45.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487498,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1,350.1863,[M+H]+,20.0,val,CCOC(=O)c1nc(N(Cc2ccccc2)C(C)C)c2ccccc2n1
487499,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487500,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487501,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,30.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487502,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,60.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487503,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,15.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487504,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487505,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,60.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487506,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1,350.1863,[M+H]+,20.0,val,CCCCc1ccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1
487507,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487508,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487509,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,60.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487510,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,30.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487511,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487512,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,30.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487513,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,60.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487514,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1,350.1863,[M+H]+,20.0,val,CCn1cc(-c2ccc(OC)cc2)cc1C(=O)NC(C)c1cccnc1
487515,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,20.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487516,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,20.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487517,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,30.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487518,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,60.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487519,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,20.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487520,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,45.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487521,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,60.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487522,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C,350.1863,[M+H]+,20.0,val,Cc1c(NC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C
487523,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487524,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487525,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,15.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487526,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,60.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487527,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,30.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487528,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487529,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,20.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487530,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1,350.1863,[M+H]+,60.0,val,Cc1cc(OCC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)ccn1
487531,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487532,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487533,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,60.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487534,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,30.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487535,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487536,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,60.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487537,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,30.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487538,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,446.13803,[M+H]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487539,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,468.11997,[M+Na]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487540,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,468.11997,[M+Na]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487541,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,468.11997,[M+Na]+,60.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487542,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,468.11997,[M+Na]+,20.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487543,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1,468.11997,[M+Na]+,45.0,val,COC(=O)c1ccc(CN2N=C(C(=O)N3CCC(C)CC3)S(=O)(=O)c3ccccc32)o1
487544,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487545,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487546,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,522.10103,[M+FA]-,60.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487547,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,522.10103,[M+FA]-,15.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487548,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487549,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487550,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487551,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,522.10103,[M+FA]-,60.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487552,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,522.10103,[M+FA]-,15.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487553,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,522.10103,[M+FA]-,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487554,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487555,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487556,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,478.1101,[M+H]+,60.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487557,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,478.1101,[M+H]+,15.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487558,COc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)C(C)CS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,COc1ccc(N2C(=O)C(C)CS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487559,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487560,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487561,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,478.1101,[M+H]+,60.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487562,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,478.1101,[M+H]+,15.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487563,CCOc1c(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc(N2C(=O)CCS2(=O)=O)cc1,478.1101,[M+H]+,20.0,val,CCOc1ccc(N2C(=O)CCS2(=O)=O)cc1S(=O)(=O)NCCc1c[nH]c2ccccc12
487564,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487565,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487566,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,60.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487567,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487568,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,45.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487569,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,60.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487570,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487571,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,392.17281,[M-H]-,45.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487572,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,428.14949,[M+Cl]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487573,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,428.14949,[M+Cl]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487574,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,428.14949,[M+Cl]-,60.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487575,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,428.14949,[M+Cl]-,15.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487576,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,428.14949,[M+Cl]-,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487577,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,392.17281,[M-H]-,20.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487578,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,394.18737,[M+H]+,20.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487579,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,394.18737,[M+H]+,20.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487580,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,394.18737,[M+H]+,60.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487581,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,394.18737,[M+H]+,15.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487582,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1,394.18737,[M+H]+,20.0,val,Cn1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(-c2ccco2)n1
487583,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487584,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487585,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,60.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487586,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,30.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487587,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487588,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,60.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487589,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,30.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487590,Cc1c(C(=O)N2CCOCC2)cccc1NC(=O)c1cc2c(nc1)n(C)nc2C,394.18737,[M+H]+,20.0,val,Cc1c(NC(=O)c2cnc3c(c2)c(C)nn3C)cccc1C(=O)N1CCOCC1
487591,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487592,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,60.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487593,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,15.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487594,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487595,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,60.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487596,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,15.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487597,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,438.17829,[M+FA]-,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487598,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487599,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487600,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487601,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487602,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487603,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487604,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,30.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487605,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cnccc2)n(C2CC2)c1=O,394.18737,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NCCn1nc(-c2cccnc2)n(C2CC2)c1=O
487606,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487607,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487608,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,60.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487609,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,30.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487610,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487611,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,60.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487612,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,30.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487613,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cnccc3)no2)C1,394.18737,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)N1CC(C)C(c2nc(-c3cccnc3)no2)C1
487614,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487615,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487616,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,45.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487617,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487618,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487619,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,45.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487620,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487621,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,438.16462,[M-H]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487622,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,474.14129,[M+Cl]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487623,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,474.14129,[M+Cl]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487624,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,474.14129,[M+Cl]-,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487625,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,474.14129,[M+Cl]-,15.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487626,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,484.17009,[M+FA]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487627,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,484.17009,[M+FA]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487628,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,484.17009,[M+FA]-,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487629,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,484.17009,[M+FA]-,15.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487630,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,484.17009,[M+FA]-,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487631,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487632,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487633,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,45.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487634,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487635,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487636,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,20.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487637,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,45.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487638,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O,440.17917,[M+H]+,60.0,val,COc1cn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(CN2CCCCC2)cc1=O
487639,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,20.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487640,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,20.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487641,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,60.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487642,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,20.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487643,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,45.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487644,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,60.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487645,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,20.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487646,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1,397.18975,[M+H]+,45.0,val,Fc1ccc(OCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1
487647,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,20.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487648,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,20.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487649,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,60.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487650,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,20.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487651,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,45.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487652,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,60.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487653,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,20.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487654,COc1c2c(cc(F)c1N1CC3CCCNC3C1)c(=O)c(C(=O)O)cn2C1CC1,402.18236,[M+H]+,45.0,val,COc1c(N2CC3CCCNC3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
487655,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487656,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487657,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,60.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487658,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,30.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487659,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487660,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,30.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487661,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,60.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487662,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,408.19536,[M-H]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487663,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,454.20084,[M+FA]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487664,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,454.20084,[M+FA]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487665,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,454.20084,[M+FA]-,60.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487666,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,454.20084,[M+FA]-,15.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487667,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,454.20084,[M+FA]-,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487668,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,410.20991,[M+H]+,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487669,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,410.20991,[M+H]+,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487670,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,410.20991,[M+H]+,60.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487671,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,410.20991,[M+H]+,15.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487672,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1,410.20991,[M+H]+,20.0,val,CCc1cccc(-n2nnnc2N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)c1
487673,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487674,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,60.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487675,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,15.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487676,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487677,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,60.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487678,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,15.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487679,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,470.19575,[M+FA]-,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487680,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487681,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487682,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,60.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487683,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487684,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,45.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487685,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,60.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487686,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,20.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487687,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1,426.20483,[M+H]+,45.0,val,NC(=O)C1CCN(c2nc(N3CCOCC3)c3cnn(-c4ccc(F)cc4)c3n2)CC1
487688,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,351.17142,[M-H]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487689,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,351.17142,[M-H]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487690,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,351.17142,[M-H]-,60.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487691,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,351.17142,[M-H]-,30.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487692,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,351.17142,[M-H]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487693,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487694,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487695,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,60.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487696,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,15.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487697,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487698,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,60.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487699,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,15.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487700,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,397.1769,[M+FA]-,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487701,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,351.17142,[M-H]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487702,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,351.17142,[M-H]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487703,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,351.17142,[M-H]-,60.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487704,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,351.17142,[M-H]-,30.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487705,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,351.17142,[M-H]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487706,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,397.1769,[M+FA]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487707,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,397.1769,[M+FA]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487708,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,397.1769,[M+FA]-,60.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487709,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,397.1769,[M+FA]-,15.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487710,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,397.1769,[M+FA]-,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487711,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487712,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487713,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,60.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487714,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,30.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487715,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487716,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,60.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487717,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,30.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487718,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cc(O)ccc1,353.18597,[M+H]+,20.0,val,CC(NC(=O)C1CCCN1C(=O)Cc1ccccc1)c1cccc(O)c1
487719,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,335.17541,[M+H-H2O]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487720,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,335.17541,[M+H-H2O]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487721,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,335.17541,[M+H-H2O]+,60.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487722,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,335.17541,[M+H-H2O]+,30.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487723,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,335.17541,[M+H-H2O]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487724,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,353.18597,[M+H]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487725,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,353.18597,[M+H]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487726,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,353.18597,[M+H]+,60.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487727,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,353.18597,[M+H]+,15.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487728,CC(=O)N1CCc2c1ccc(C(=O)NCC(O)c1cc(C)cc(C)c1)c2,353.18597,[M+H]+,20.0,val,CC(=O)N1CCc2cc(C(=O)NCC(O)c3cc(C)cc(C)c3)ccc21
487729,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1,353.18597,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1
487730,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1,353.18597,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1
487731,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1,353.18597,[M+H]+,60.0,val,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1
487732,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1,353.18597,[M+H]+,15.0,val,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1
487733,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1,353.18597,[M+H]+,20.0,val,CCOc1ccccc1C(=O)NCC(=O)NC1CC(c2ccccc2)C1
487734,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12,353.18597,[M+H]+,20.0,val,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
487735,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12,353.18597,[M+H]+,20.0,val,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
487736,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12,353.18597,[M+H]+,60.0,val,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
487737,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12,353.18597,[M+H]+,20.0,val,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
487738,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12,353.18597,[M+H]+,45.0,val,COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
487739,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,20.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487740,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,20.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487741,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,60.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487742,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,20.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487743,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,60.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487744,COc1c(OC)cc2c(c1)[C@@H]1CCN3CC=C[C@@]45CC[C@H]1[C@@]34N2C(=O)C5,353.18597,[M+H]+,20.0,val,COc1cc2c(cc1OC)N1C(=O)C[C@]34C=CCN5CC[C@@H]2[C@@H](CC3)[C@]514
487745,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487746,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487747,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,60.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487748,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487749,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487750,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,351.17142,[M-H]-,60.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487751,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,387.14809,[M+Cl]-,15.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487752,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,387.14809,[M+Cl]-,15.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487753,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487754,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487755,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,351.17142,[M-H]-,45.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487756,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,351.17142,[M-H]-,60.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487757,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487758,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487759,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487760,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,397.1769,[M+FA]-,60.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487761,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,397.1769,[M+FA]-,15.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487762,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487763,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487764,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487765,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,351.17142,[M-H]-,45.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487766,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,351.17142,[M-H]-,60.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487767,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,351.17142,[M-H]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487768,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,387.14809,[M+Cl]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487769,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,387.14809,[M+Cl]-,15.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487770,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487771,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487772,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487773,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487774,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487775,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,60.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487776,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487777,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,351.17142,[M-H]-,45.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487778,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,351.17142,[M-H]-,45.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487779,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,351.17142,[M-H]-,45.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487780,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,351.17142,[M-H]-,60.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487781,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487782,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487783,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,60.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487784,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487785,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487786,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487787,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,15.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487788,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,397.1769,[M+FA]-,60.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487789,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487790,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487791,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,60.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487792,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,30.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487793,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487794,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,30.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487795,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,60.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487796,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)c3ccc(C)c(C)c3)CC2=O)cc1
487797,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487798,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487799,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,45.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487800,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,60.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487801,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487802,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,60.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487803,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,45.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487804,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1,353.18597,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(C)C)c1
487805,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487806,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487807,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,60.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487808,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,30.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487809,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487810,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,60.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487811,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,30.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487812,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(CCC(=O)Nc2ccc3c(c2)N(C(C)=O)CCC3)cc1
487813,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487814,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487815,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,353.18597,[M+H]+,60.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487816,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,353.18597,[M+H]+,30.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487817,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1,353.18597,[M+H]+,20.0,val,COc1ccc(N2CC(CNC(=O)CCc3ccccc3)CC2=O)cc1
487818,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,45.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487819,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,45.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487820,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,45.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487821,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,20.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487822,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,60.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487823,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,60.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487824,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,45.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487825,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1,353.18597,[M+H]+,20.0,val,COc1cc(CN2CCCC(c3nc4ccccc4o3)C2)cc(OC)c1
487826,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,375.19388,[M-H]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487827,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,375.19388,[M-H]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487828,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,375.19388,[M-H]-,60.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487829,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,375.19388,[M-H]-,30.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487830,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,375.19388,[M-H]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487831,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,421.19936,[M+FA]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487832,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,421.19936,[M+FA]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487833,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,421.19936,[M+FA]-,60.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487834,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,421.19936,[M+FA]-,15.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487835,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,421.19936,[M+FA]-,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487836,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487837,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487838,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,60.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487839,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487840,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,60.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487841,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,341.18732,[M+H-2H2O]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487842,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,377.20844,[M+H]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487843,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,377.20844,[M+H]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487844,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,377.20844,[M+H]+,60.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487845,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,377.20844,[M+H]+,15.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487846,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1,377.20844,[M+H]+,20.0,val,O=C(NCC1CCN(CCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1
487847,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,20.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487848,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,20.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487849,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,60.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487850,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,20.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487851,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,45.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487852,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,60.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487853,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,20.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487854,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1,377.20844,[M+H]+,45.0,val,CC(C)c1nccc(N2CCN(c3cc(=O)[nH]nc3-c3ccccc3)CC2)n1
487855,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487856,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487857,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,60.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487858,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487859,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,45.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487860,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,60.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487861,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487862,CCCNc1nn2c(-c3cc4c(cc3)n(C3CCCCO3)nc4)cnc2cc1,377.20844,[M+H]+,45.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487863,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,20.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487864,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,20.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487865,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,60.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487866,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,20.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487867,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,60.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487868,COc1cccc(Nc2nc(N3CCCC3)nc(Nc3cccc(C)c3)n2)c1,377.20844,[M+H]+,20.0,val,COc1cccc(Nc2nc(Nc3cccc(C)c3)nc(N3CCCC3)n2)c1
487869,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,20.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487870,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,20.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487871,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,60.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487872,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,20.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487873,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,60.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487874,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1,377.20844,[M+H]+,20.0,val,Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(N2CCOCC2)n1
487875,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,421.19936,[M+FA]-,60.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487876,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,421.19936,[M+FA]-,15.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487877,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,421.19936,[M+FA]-,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487878,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487879,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487880,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,45.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487881,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,60.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487882,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487883,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,45.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487884,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,20.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487885,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1,377.20844,[M+H]+,60.0,val,CCCNc1ccc2ncc(-c3ccc4c(cnn4C4CCCCO4)c3)n2n1
487886,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487887,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487888,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,60.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487889,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487890,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,60.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487891,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1,377.20844,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCCCC3)nc(C(=O)NCc3cccnc3)nc2n1
487892,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487893,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487894,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487895,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487896,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487897,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,45.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487898,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,20.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487899,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12,377.20844,[M+H]+,60.0,val,COc1ccccc1-c1c(C)nn2c(NCCCn3ccnc3)cc(C)nc12
487900,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,20.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487901,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,20.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487902,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,45.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487903,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,60.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487904,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,20.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487905,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,45.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487906,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,60.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487907,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1,489.13732,[M+H]+,20.0,val,O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ccccn4)CC3)c2)o1)N1CCCCC1
487908,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,447.12522,[M+H-H2O]+,20.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487909,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,447.12522,[M+H-H2O]+,20.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487910,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,447.12522,[M+H-H2O]+,60.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487911,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,447.12522,[M+H-H2O]+,15.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487912,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,447.12522,[M+H-H2O]+,20.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487913,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,465.13578,[M+H]+,15.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487914,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,465.13578,[M+H]+,15.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487915,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,465.13578,[M+H]+,60.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487916,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,465.13578,[M+H]+,20.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487917,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1,465.13578,[M+H]+,15.0,val,CC(C)CC(NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O/N=C(\N)c1cccs1
487918,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2,391.21041,[M+H]+,20.0,val,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2
487919,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2,391.21041,[M+H]+,20.0,val,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2
487920,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2,391.21041,[M+H]+,60.0,val,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2
487921,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2,391.21041,[M+H]+,30.0,val,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2
487922,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2,391.21041,[M+H]+,20.0,val,FC(F)(F)c1nc(N2CCN(Cc3ccccc3)CC2)nc2c1CCCCC2
487923,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,20.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487924,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,20.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487925,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,45.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487926,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,60.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487927,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,20.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487928,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,45.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487929,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,60.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487930,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1,448.11817,[M+H]+,20.0,val,Cc1nc(-c2cc(S(=O)(=O)N3CCN(c4cccc(C)c4C)CC3)c(C)s2)cs1
487931,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC,432.17653,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC
487932,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC,432.17653,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC
487933,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC,432.17653,[M+H]+,60.0,val,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC
487934,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC,432.17653,[M+H]+,15.0,val,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC
487935,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC,432.17653,[M+H]+,20.0,val,COc1cc(C(=O)Nc2cc(C(=O)N3CCOCC3)cn(C)c2=O)cc(OC)c1OC
487936,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487937,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487938,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,60.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487939,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487940,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,60.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487941,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,394.1707,[M-H]-,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487942,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,396.18526,[M+H]+,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487943,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,396.18526,[M+H]+,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487944,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,396.18526,[M+H]+,60.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487945,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,396.18526,[M+H]+,20.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487946,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1,396.18526,[M+H]+,45.0,val,CC1CCCN(Cc2csc(NC(=O)c3cccc(Cn4ccnc4)c3)n2)C1
487947,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1,432.17969,[M+H]+,20.0,val,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1
487948,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1,432.17969,[M+H]+,20.0,val,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1
487949,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1,432.17969,[M+H]+,45.0,val,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1
487950,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1,432.17969,[M+H]+,60.0,val,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1
487951,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1,432.17969,[M+H]+,20.0,val,COc1ccc(Cl)cc1C(=O)N1CCN(c2nc(C)cc(N3CCOCC3)n2)CC1
487952,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,460.20017,[M+FA]-,15.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487953,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,460.20017,[M+FA]-,15.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487954,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,460.20017,[M+FA]-,60.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487955,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,460.20017,[M+FA]-,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487956,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,460.20017,[M+FA]-,15.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487957,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487958,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487959,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,45.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487960,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,60.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487961,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487962,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,45.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487963,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,60.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487964,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1,416.20924,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)NC4CCOCC4)CC3)c2F)cc1
487965,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,20.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487966,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,20.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487967,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,60.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487968,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,20.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487969,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,45.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487970,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,60.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487971,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,20.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487972,CCc1ccc(C2CCCN(C(=O)CCc3c[nH]c(=O)cc3)C2)cc1,339.2067,[M+H]+,45.0,val,CCc1ccc(C2CCCN(C(=O)CCc3ccc(=O)[nH]c3)C2)cc1
487973,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487974,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487975,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487976,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487977,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487978,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487979,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487980,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487981,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487982,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487983,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,339.2067,[M+H]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487984,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,339.2067,[M+H]+,15.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487985,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487986,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,361.18865,[M+Na]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487987,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,361.18865,[M+Na]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487988,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,361.18865,[M+Na]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487989,Cc1cc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)ccc1,361.18865,[M+Na]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
487990,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,20.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487991,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,20.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487992,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,60.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487993,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,20.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487994,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,60.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487995,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13,339.2067,[M+H]+,20.0,val,CCC1CC2CN3CCc4c([nH]c5ccccc45)C(C(=O)OC)(C2)C13
487996,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
487997,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
487998,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
487999,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,30.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488000,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488001,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,30.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488002,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488003,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,337.19215,[M-H]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488004,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488005,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488006,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488007,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488008,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488009,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488010,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488011,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,373.16883,[M+Cl]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488012,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488013,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488014,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488015,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488016,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488017,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488018,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488019,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,383.19763,[M+FA]-,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488020,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,337.19215,[M-H]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488021,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,337.19215,[M-H]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488022,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,337.19215,[M-H]-,45.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488023,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,337.19215,[M-H]-,60.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488024,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,337.19215,[M-H]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488025,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488026,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488027,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,60.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488028,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,15.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488029,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488030,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,15.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488031,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488032,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,383.19763,[M+FA]-,60.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488033,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,337.19215,[M-H]-,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488034,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,337.19215,[M-H]-,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488035,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,337.19215,[M-H]-,60.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488036,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,337.19215,[M-H]-,30.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488037,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,337.19215,[M-H]-,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488038,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,337.19215,[M-H]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488039,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,337.19215,[M-H]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488040,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,337.19215,[M-H]-,45.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488041,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,337.19215,[M-H]-,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488042,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,337.19215,[M-H]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488043,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,373.16883,[M+Cl]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488044,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,373.16883,[M+Cl]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488045,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,373.16883,[M+Cl]-,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488046,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,373.16883,[M+Cl]-,15.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488047,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488048,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488049,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488050,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,15.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488051,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488052,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,15.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488053,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488054,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,383.19763,[M+FA]-,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488055,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,337.19215,[M-H]-,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488056,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,337.19215,[M-H]-,60.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488057,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,337.19215,[M-H]-,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488058,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,337.19215,[M-H]-,60.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488059,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488060,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488061,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,60.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488062,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,30.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488063,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488064,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,60.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488065,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,30.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488066,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CC(NC(=O)CCCC(=O)NC(C)c1ccccc1)c1ccccc1
488067,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488068,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488069,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488070,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488071,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488072,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,30.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488073,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488074,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,321.19614,[M+H-H2O]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488075,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488076,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488077,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488078,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,15.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488079,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488080,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,15.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488081,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,60.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488082,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1,339.2067,[M+H]+,20.0,val,Cc1cccc(C(O)(C(=O)NN2CCCCC2)c2cccc(C)c2)c1
488083,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,339.2067,[M+H]+,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488084,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,339.2067,[M+H]+,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488085,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,339.2067,[M+H]+,60.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488086,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,339.2067,[M+H]+,30.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488087,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C,339.2067,[M+H]+,20.0,val,Cc1cccc(NC(=O)CCCC(=O)Nc2cccc(C)c2C)c1C
488088,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488089,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488090,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,45.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488091,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488092,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488093,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,20.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488094,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,60.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488095,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1,339.2067,[M+H]+,45.0,val,Cc1ccccc1CCC(=O)NC(c1cccnc1)C1CCOCC1
488096,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488097,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488098,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,60.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488099,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,30.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488100,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488101,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,30.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488102,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,20.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488103,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1,339.2067,[M+H]+,60.0,val,CC(C)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
488104,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1,339.2067,[M+H]+,20.0,val,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1
488105,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1,339.2067,[M+H]+,20.0,val,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1
488106,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1,339.2067,[M+H]+,45.0,val,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1
488107,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1,339.2067,[M+H]+,60.0,val,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1
488108,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1,339.2067,[M+H]+,20.0,val,CCC(O)c1nc2ccccc2n1CCCCOc1ccc(C)cc1
488109,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488110,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488111,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488112,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488113,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488114,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,60.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488115,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,20.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488116,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C,339.2067,[M+H]+,15.0,val,Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C)c(C)c2)cc1C
488117,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488118,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488119,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,45.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488120,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488121,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488122,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,60.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488123,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,45.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488124,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1,339.2067,[M+H]+,20.0,val,CC(Oc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1
488125,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2,339.2067,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2
488126,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2,339.2067,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2
488127,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2,339.2067,[M+H]+,60.0,val,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2
488128,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2,339.2067,[M+H]+,30.0,val,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2
488129,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2,339.2067,[M+H]+,20.0,val,CC(C)(C)OC(=O)NCc1cccc2c1CN(Cc1ccccc1)C2
488130,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488131,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488132,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,60.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488133,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,15.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488134,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488135,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,60.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488136,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,15.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488137,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1,339.2067,[M+H]+,20.0,val,CCN(C(=O)CCCC(=O)N(CC)c1ccccc1)c1ccccc1
488138,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488139,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488140,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,60.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488141,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,30.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488142,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488143,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,60.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488144,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,30.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488145,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,401.15405,[M-H]-,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488146,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,447.15953,[M+FA]-,15.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488147,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,447.15953,[M+FA]-,15.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488148,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,447.15953,[M+FA]-,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488149,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,447.15953,[M+FA]-,60.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488150,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,447.15953,[M+FA]-,15.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488151,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,403.1686,[M+H]+,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488152,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,403.1686,[M+H]+,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488153,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,403.1686,[M+H]+,60.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488154,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,403.1686,[M+H]+,30.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488155,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1,403.1686,[M+H]+,20.0,val,CCc1ccc(OCCCNS(=O)(=O)c2ccc(C3CNC(=O)C3)cc2)cc1
488156,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488157,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488158,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,60.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488159,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,30.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488160,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488161,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,60.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488162,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,30.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488163,O=S(=O)(CCc1ccccc1)NCC(c1cc2c(cc1)OCO2)N1CCCC1,403.1686,[M+H]+,20.0,val,O=S(=O)(CCc1ccccc1)NCC(c1ccc2c(c1)OCO2)N1CCCC1
488164,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,401.15405,[M-H]-,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488165,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,401.15405,[M-H]-,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488166,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,401.15405,[M-H]-,45.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488167,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,401.15405,[M-H]-,60.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488168,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,401.15405,[M-H]-,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488169,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488170,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488171,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,30.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488172,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,60.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488173,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488174,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,60.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488175,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,401.15405,[M-H]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488176,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,437.13073,[M+Cl]-,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488177,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,437.13073,[M+Cl]-,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488178,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,437.13073,[M+Cl]-,60.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488179,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,437.13073,[M+Cl]-,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488180,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,447.15953,[M+FA]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488181,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,447.15953,[M+FA]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488182,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,447.15953,[M+FA]-,60.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488183,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,447.15953,[M+FA]-,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488184,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,447.15953,[M+FA]-,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488185,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488186,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488187,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488188,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488189,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488190,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,401.15405,[M-H]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488191,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,437.13073,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488192,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,437.13073,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488193,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,437.13073,[M+Cl]-,60.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488194,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,437.13073,[M+Cl]-,15.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488195,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,437.13073,[M+Cl]-,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488196,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488197,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488198,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,401.15405,[M-H]-,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488199,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,401.15405,[M-H]-,30.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488200,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488201,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488202,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488203,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488204,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488205,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488206,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,401.15405,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488207,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488208,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488209,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,401.15405,[M-H]-,45.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488210,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,401.15405,[M-H]-,60.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488211,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,401.15405,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488212,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488213,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488214,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488215,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488216,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488217,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488218,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488219,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C,403.1686,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCN3C(=O)C(C)C)cc1C
488220,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488221,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488222,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488223,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,60.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488224,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488225,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488226,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,60.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488227,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
488228,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,403.1686,[M+H]+,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488229,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,403.1686,[M+H]+,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488230,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,403.1686,[M+H]+,60.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488231,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,403.1686,[M+H]+,20.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488232,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1,403.1686,[M+H]+,15.0,val,Cc1ccc(C)c(S(=O)(=O)NC2CCCC(OC(=O)Nc3ccccc3)C2)c1
488233,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488234,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488235,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488236,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488237,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488238,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,30.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488239,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,60.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488240,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1,403.1686,[M+H]+,20.0,val,CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CCCCC2)cc1
488241,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488242,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488243,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488244,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488245,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488246,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488247,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488248,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488249,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,425.15055,[M+Na]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488250,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,425.15055,[M+Na]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488251,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,425.15055,[M+Na]+,45.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488252,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,425.15055,[M+Na]+,60.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488253,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,425.15055,[M+Na]+,20.0,val,CCCCOc1ccc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1
488254,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488255,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488256,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488257,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488258,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488259,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488260,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488261,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1,403.1686,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)cc1
488262,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488263,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488264,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,60.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488265,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,30.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488266,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488267,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,60.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488268,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,30.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488269,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C,403.1686,[M+H]+,20.0,val,Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c(C)c1C
488270,CCOc1c(OC)cc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1,387.19145,[M+H]+,20.0,val,CCOc1ccc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1OC
488271,CCOc1c(OC)cc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1,387.19145,[M+H]+,20.0,val,CCOc1ccc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1OC
488272,CCOc1c(OC)cc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1,387.19145,[M+H]+,60.0,val,CCOc1ccc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1OC
488273,CCOc1c(OC)cc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1,387.19145,[M+H]+,15.0,val,CCOc1ccc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1OC
488274,CCOc1c(OC)cc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1,387.19145,[M+H]+,20.0,val,CCOc1ccc(CNC(=O)C2CCCCN2C(=O)c2ccco2)cc1OC
488275,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488276,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488277,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488278,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488279,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,45.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488280,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488281,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488282,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,45.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488283,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,421.15357,[M+Cl]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488284,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,421.15357,[M+Cl]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488285,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,421.15357,[M+Cl]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488286,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,421.15357,[M+Cl]-,15.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488287,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,421.15357,[M+Cl]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488288,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488289,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488290,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488291,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,15.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488292,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488293,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488294,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488295,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488296,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488297,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,45.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488298,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488299,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488300,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,385.1769,[M-H]-,45.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488301,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488302,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488303,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488304,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,15.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488305,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,431.18237,[M+FA]-,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488306,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488307,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488308,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488309,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,30.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488310,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488311,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488312,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,30.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488313,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488314,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488315,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488316,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,15.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488317,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488318,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,30.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488319,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488320,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,60.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488321,COc1ccc(CC(C)(C)NC[C@H](O)c2c3OCC(=O)Nc3cc(O)c2)cc1,387.19145,[M+H]+,20.0,val,COc1ccc(CC(C)(C)NC[C@H](O)c2cc(O)cc3c2OCC(=O)N3)cc1
488322,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488323,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488324,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,60.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488325,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,30.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488326,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488327,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,30.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488328,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,20.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488329,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1,339.18895,[M+H]+,60.0,val,Cc1cc(C)cc(NC(=S)N2CCC(Cc3ccccc3)CC2)c1
488330,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1,339.18895,[M+H]+,20.0,val,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1
488331,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1,339.18895,[M+H]+,20.0,val,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1
488332,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1,339.18895,[M+H]+,60.0,val,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1
488333,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1,339.18895,[M+H]+,30.0,val,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1
488334,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1,339.18895,[M+H]+,20.0,val,c1ccc(CN2CCN(C3CCCSc4ccccc43)CC2)cc1
488335,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,467.21607,[M+FA]-,20.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488336,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,467.21607,[M+FA]-,60.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488337,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,467.21607,[M+FA]-,15.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488338,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,467.21607,[M+FA]-,20.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488339,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,423.22515,[M+H]+,20.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488340,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,423.22515,[M+H]+,20.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488341,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,423.22515,[M+H]+,60.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488342,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,423.22515,[M+H]+,20.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488343,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12,423.22515,[M+H]+,45.0,val,CCc1nnc2ccc(N3CC4CN(C(=O)Cn5cnc(C)c(C)c5=O)CC4C3)nn12
488344,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,505.11183,[M+Cl]-,30.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488345,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488346,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488347,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,60.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488348,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488349,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488350,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,60.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488351,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,15.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488352,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,515.14063,[M+FA]-,20.0,val,COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1
488353,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,469.13515,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488354,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,469.13515,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488355,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,469.13515,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488356,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,469.13515,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488357,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,469.13515,[M-H]-,45.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488358,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,505.11183,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488359,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,505.11183,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488360,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,505.11183,[M+Cl]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488361,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,505.11183,[M+Cl]-,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488362,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,505.11183,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488363,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,471.1497,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488364,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,471.1497,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488365,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,471.1497,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488366,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,471.1497,[M+H]+,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488367,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,471.1497,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488368,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,488.17625,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488369,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,488.17625,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488370,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,488.17625,[M+NH4]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488371,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,488.17625,[M+NH4]+,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488372,O=C(/C=C/c1cc(O)c(O)cc1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O,488.17625,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1O
488373,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,438.18777,[M+Cl]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488374,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,438.18777,[M+Cl]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488375,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,438.18777,[M+Cl]-,60.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488376,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,438.18777,[M+Cl]-,15.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488377,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,438.18777,[M+Cl]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488378,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,448.21657,[M+FA]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488379,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,448.21657,[M+FA]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488380,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,448.21657,[M+FA]-,60.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488381,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,448.21657,[M+FA]-,15.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488382,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,448.21657,[M+FA]-,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488383,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488384,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488385,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,60.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488386,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488387,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,45.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488388,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,60.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488389,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1,404.22564,[M+H]+,20.0,val,CCNc1cc(N2CCCC(CCC(=O)NCc3cc(F)cc(F)c3)C2)ncn1
488390,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488391,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488392,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,45.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488393,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488394,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488395,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,45.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488396,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488397,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,417.19436,[M-H]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488398,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,453.17104,[M+Cl]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488399,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,453.17104,[M+Cl]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488400,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,453.17104,[M+Cl]-,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488401,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,453.17104,[M+Cl]-,15.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488402,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,453.17104,[M+Cl]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488403,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,463.19984,[M+FA]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488404,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,463.19984,[M+FA]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488405,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,463.19984,[M+FA]-,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488406,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,463.19984,[M+FA]-,15.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488407,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,463.19984,[M+FA]-,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488408,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488409,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488410,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,45.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488411,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488412,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488413,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,60.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488414,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,45.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488415,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1,419.20891,[M+H]+,20.0,val,O=C(CN1CCC2(CC1)NC(=O)N(Cc1ccc(F)cc1)C2=O)NCC1CCCO1
488416,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488417,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488418,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488419,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488420,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488421,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488422,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488423,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488424,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,30.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488425,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488426,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488427,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488428,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488429,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488430,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488431,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488432,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488433,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488434,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,30.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488435,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488436,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488437,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488438,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488439,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488440,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488441,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488442,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,393.17189,[M-H]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488443,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488444,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488445,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488446,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,30.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488447,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,429.14857,[M+Cl]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488448,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488449,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488450,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488451,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488452,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488453,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488454,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488455,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,439.17737,[M+FA]-,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488456,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488457,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488458,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488459,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488460,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488461,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,60.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488462,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,15.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488463,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F,395.18644,[M+H]+,20.0,val,C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
488464,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,336.20814,[M-H]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488465,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,336.20814,[M-H]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488466,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,336.20814,[M-H]-,60.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488467,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,336.20814,[M-H]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488468,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,336.20814,[M-H]-,45.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488469,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,372.18481,[M+Cl]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488470,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,372.18481,[M+Cl]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488471,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,382.21361,[M+FA]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488472,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,382.21361,[M+FA]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488473,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,382.21361,[M+FA]-,60.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488474,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,382.21361,[M+FA]-,15.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488475,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,382.21361,[M+FA]-,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488476,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488477,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488478,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,60.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488479,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,30.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488480,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488481,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,60.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488482,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,30.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488483,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1,338.22269,[M+H]+,20.0,val,O=C(NCC1(Cc2ccccc2)CCCCC1)[C@H]1C[C@@H]1c1c[nH]cn1
488484,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,20.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488485,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,20.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488486,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,60.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488487,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,30.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488488,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,20.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488489,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,60.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488490,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,30.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488491,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1,338.22269,[M+H]+,20.0,val,Cc1cc(OC2CN(C3CCN(Cc4ccccc4)CC3)C2)ccn1
488492,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488493,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488494,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,60.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488495,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,15.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488496,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488497,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,60.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488498,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488499,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21,338.22269,[M+H]+,15.0,val,CCn1c2ccccc2c2cc(CNCCN3CCOCC3)ccc21
488500,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,20.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488501,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,20.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488502,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,30.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488503,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,60.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488504,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,20.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488505,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,45.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488506,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,60.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488507,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1,426.20705,[M+H]+,20.0,val,CCN(CCNC(=O)c1nc(N2CCSCC2)c2cnn(C)c2n1)c1ccccc1
488508,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488509,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488510,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,30.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488511,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488512,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488513,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,372.16389,[M-H]-,30.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488514,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,408.14057,[M+Cl]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488515,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,408.14057,[M+Cl]-,15.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488516,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488517,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488518,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,60.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488519,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,15.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488520,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488521,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,15.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488522,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488523,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,418.16937,[M+FA]-,60.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488524,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488525,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488526,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,60.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488527,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,30.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488528,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488529,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,60.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488530,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,30.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488531,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1,374.17844,[M+H]+,20.0,val,O=C(NCCC(CCO)c1cccs1)C1(c2ccccc2)CCOCC1
488532,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,20.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488533,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,20.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488534,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,60.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488535,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,30.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488536,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,20.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488537,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,60.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488538,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,30.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488539,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21,374.17844,[M+H]+,20.0,val,CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCCc2ccccc21
488540,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,20.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488541,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,20.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488542,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,60.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488543,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,30.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488544,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,20.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488545,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,30.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488546,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,60.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488547,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1,428.21555,[M+H]+,20.0,val,O=C(C1CCCO1)N1CCC(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)CC1
488548,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488549,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488550,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,15.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488551,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,60.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488552,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,30.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488553,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488554,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,60.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488555,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488556,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488557,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488558,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,60.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488559,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,30.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488560,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488561,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,60.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488562,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,30.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488563,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1,341.22235,[M+H]+,20.0,val,OCCOCCN1CCN(C(c2ccccc2)c2ccccc2)CC1
488564,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,20.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488565,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,20.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488566,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,60.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488567,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,30.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488568,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,20.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488569,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,60.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488570,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,30.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488571,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1,341.22235,[M+H]+,20.0,val,Cc1ccc(COc2ccccc2CNCCN2CCOCC2)cc1
488572,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,20.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488573,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,20.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488574,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,60.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488575,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,30.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488576,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,20.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488577,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,60.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488578,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,30.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488579,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1,341.22235,[M+H]+,20.0,val,CC1(C)CC(NC(=O)COc2ccc3ccccc3c2)CC(C)(C)N1
488580,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488581,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488582,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,60.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488583,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,30.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488584,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488585,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,30.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488586,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,60.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488587,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1,341.22235,[M+H]+,20.0,val,Cc1cc(C)c(C(=O)NCC2CCN(Cc3ccco3)CC2)c(C)c1
488588,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488589,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488590,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,60.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488591,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488592,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,45.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488593,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,60.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488594,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488595,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,371.19763,[M-H]-,45.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488596,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,20.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488597,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,20.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488598,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,60.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488599,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,15.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488600,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,20.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488601,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,60.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488602,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,15.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488603,CN1CCC(C(=O)N(Cc2cc3c(cc2)OCO3)C2CCCCC2)CC1=O,373.21218,[M+H]+,20.0,val,CN1CCC(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCCC2)CC1=O
488604,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,373.21218,[M+H]+,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488605,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,373.21218,[M+H]+,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488606,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,373.21218,[M+H]+,60.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488607,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,373.21218,[M+H]+,30.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488608,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1,373.21218,[M+H]+,20.0,val,O=C(O)c1ccc(CC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1
488609,COc1cc2c(cc1)CN(C(=O)C1CC(=O)N(C3CCCCC3)C1)CCO2,373.21218,[M+H]+,20.0,val,COc1ccc2c(c1)OCCN(C(=O)C1CC(=O)N(C3CCCCC3)C1)C2
488610,COc1cc2c(cc1)CN(C(=O)C1CC(=O)N(C3CCCCC3)C1)CCO2,373.21218,[M+H]+,20.0,val,COc1ccc2c(c1)OCCN(C(=O)C1CC(=O)N(C3CCCCC3)C1)C2
488611,COc1cc2c(cc1)CN(C(=O)C1CC(=O)N(C3CCCCC3)C1)CCO2,373.21218,[M+H]+,60.0,val,COc1ccc2c(c1)OCCN(C(=O)C1CC(=O)N(C3CCCCC3)C1)C2
488612,COc1cc2c(cc1)CN(C(=O)C1CC(=O)N(C3CCCCC3)C1)CCO2,373.21218,[M+H]+,30.0,val,COc1ccc2c(c1)OCCN(C(=O)C1CC(=O)N(C3CCCCC3)C1)C2
488613,COc1cc2c(cc1)CN(C(=O)C1CC(=O)N(C3CCCCC3)C1)CCO2,373.21218,[M+H]+,20.0,val,COc1ccc2c(c1)OCCN(C(=O)C1CC(=O)N(C3CCCCC3)C1)C2
488614,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,431.17585,[M-H]-,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488615,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,431.17585,[M-H]-,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488616,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,431.17585,[M-H]-,60.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488617,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,431.17585,[M-H]-,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488618,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,431.17585,[M-H]-,45.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488619,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488620,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488621,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,60.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488622,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,30.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488623,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488624,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,60.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488625,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,30.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488626,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C,433.1904,[M+H]+,20.0,val,COCCOc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
488627,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488628,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488629,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,60.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488630,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,30.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488631,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488632,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,60.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488633,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,30.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488634,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,431.17585,[M-H]-,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488635,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1,433.1904,[M+H]+,20.0,val,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1
488636,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1,433.1904,[M+H]+,20.0,val,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1
488637,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1,433.1904,[M+H]+,60.0,val,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1
488638,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1,433.1904,[M+H]+,30.0,val,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1
488639,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1,433.1904,[M+H]+,20.0,val,CCc1ccc(OCC(O)Cn2c(SC(C)CC)nc3c2c(=O)[nH]c(=O)n3C)cc1
488640,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488641,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488642,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,60.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488643,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488644,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488645,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,60.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488646,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488647,COc1c(OC)c(OC)c(C(c2c(O)n3ncnc3s2)N(C)C2CCCCC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(C(c2sc3ncnn3c2O)N(C)C2CCCCC2)c(OC)c1OC
488648,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1,477.18133,[M+FA]-,20.0,val,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1
488649,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1,477.18133,[M+FA]-,20.0,val,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1
488650,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1,477.18133,[M+FA]-,60.0,val,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1
488651,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1,477.18133,[M+FA]-,15.0,val,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1
488652,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1,477.18133,[M+FA]-,20.0,val,O=C(NC1CCCCCC1)c1nnc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1
488653,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488654,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488655,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,60.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488656,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,15.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488657,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488658,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,15.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488659,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,60.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488660,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,477.18133,[M+FA]-,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488661,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1,433.1904,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1
488662,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1,433.1904,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1
488663,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1,433.1904,[M+H]+,45.0,val,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1
488664,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1,433.1904,[M+H]+,60.0,val,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1
488665,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1,433.1904,[M+H]+,20.0,val,CC1CCN(S(=O)(=O)c2ccc(-c3nnc(C(=O)N4CCCCCC4)o3)cc2)CC1
488666,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488667,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488668,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488669,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,60.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488670,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488671,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,20.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488672,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,60.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488673,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1,433.1904,[M+H]+,30.0,val,COc1ccc(CC(=O)NCCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1
488674,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,20.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488675,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,20.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488676,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,60.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488677,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,30.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488678,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,20.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488679,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,60.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488680,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,30.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488681,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1,385.20566,[M+H]+,20.0,val,Cc1ccc(CN(Cc2cc(=O)n3nc(C(C)C)sc3n2)CC(C)C)cc1
488682,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488683,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488684,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488685,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,30.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488686,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488687,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,60.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488688,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,30.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488689,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1,385.20566,[M+H]+,20.0,val,CCc1cccc(C)c1NC(=O)CSc1nccnc1N1CCCC(C)C1
488690,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,20.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488691,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,20.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488692,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,60.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488693,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,20.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488694,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,45.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488695,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,60.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488696,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,20.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488697,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12,365.24482,[M+H]+,45.0,val,CCc1nnc2cc(N3CCN(Cc4ccc(C(C)C)cc4)CC3)cnn12
488698,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488699,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488700,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,60.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488701,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,30.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488702,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488703,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488704,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488705,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,60.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488706,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488707,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488708,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488709,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,60.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488710,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488711,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488712,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488713,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488714,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,60.0,val,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488715,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,30.0,val,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488716,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488717,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488718,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488719,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488720,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,60.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488721,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488722,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488723,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488724,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,60.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488725,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,30.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488726,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488727,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,60.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488728,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,30.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488729,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C
488730,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488731,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488732,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,60.0,val,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488733,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,30.0,val,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488734,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC,313.21621,[M+H]+,20.0,val,C#C[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
488735,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488736,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488737,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,45.0,val,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488738,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,60.0,val,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488739,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,313.21621,[M+H]+,20.0,val,C/C=C1\C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
488740,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O,423.16606,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O
488741,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O,423.16606,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O
488742,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O,423.16606,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O
488743,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O,423.16606,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](OC2CCCCC2O)O[C@H](CO)[C@@H](O)[C@@H]1O
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488799,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,30.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488800,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,20.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488801,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,20.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488802,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,20.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488803,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,60.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488804,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,15.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488805,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC,577.09622,[M+H]+,20.0,val,CCOC(=O)CNC(=O)[C@H](CSC(=O)N(O)c1ccc(Br)cc1)NC(=O)CC[C@H](N)C(=O)OCC
488806,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1,339.25432,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1
488807,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1,339.25432,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1
488808,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1,339.25432,[M+H]+,60.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1
488809,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1,339.25432,[M+H]+,30.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1
488810,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1,339.25432,[M+H]+,20.0,val,CC(C)(C)c1cn(C2CC3CCC(C2)N3CCc2ccccc2)nn1
488811,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,453.19102,[M+Cl]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488812,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,453.19102,[M+Cl]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488813,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,453.19102,[M+Cl]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488814,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,463.21982,[M+FA]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488815,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,463.21982,[M+FA]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488816,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,463.21982,[M+FA]-,60.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488817,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,463.21982,[M+FA]-,15.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488818,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,463.21982,[M+FA]-,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488819,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488820,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488821,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,60.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488822,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,15.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488823,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488824,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,60.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488825,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,15.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488826,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O,419.2289,[M+H]+,20.0,val,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)NCC(N)=O
488827,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,391.22385,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488828,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,391.22385,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488829,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,391.22385,[M-H]-,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488830,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,391.22385,[M-H]-,30.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488831,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,391.22385,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488832,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,437.22932,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488833,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,437.22932,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488834,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,437.22932,[M+FA]-,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488835,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,437.22932,[M+FA]-,15.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488836,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,437.22932,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488837,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488838,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488839,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488840,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,15.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488841,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488842,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488843,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,15.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488844,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,393.2384,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488845,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,415.22034,[M+Na]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488846,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,415.22034,[M+Na]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488847,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1,415.22034,[M+Na]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)c1ccc(OC)cc1
488848,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,20.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488849,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,20.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488850,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,60.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488851,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,30.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488852,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,20.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488853,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,60.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488854,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,473.20284,[M+FA]-,20.0,val,C=C[C@]1(C)C[C@H](O)[C@@H]2[C@H](OC(=O)[C@@H]2C)C1/C(C)=C/O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
488855,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,473.20284,[M+FA]-,20.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488856,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,473.20284,[M+FA]-,20.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488857,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,473.20284,[M+FA]-,60.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488858,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,473.20284,[M+FA]-,15.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488859,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,473.20284,[M+FA]-,20.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488860,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,446.23846,[M+NH4]+,20.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488861,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,446.23846,[M+NH4]+,20.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
488862,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12,446.23846,[M+NH4]+,60.0,val,C=C1C(=O)OC2CC(C)=C(C(C)CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)C12
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488916,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O,473.26059,[M+H]+,20.0,val,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O
488917,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O,473.26059,[M+H]+,60.0,val,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O
488918,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O,473.26059,[M+H]+,30.0,val,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O
488919,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O,473.26059,[M+H]+,20.0,val,CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O
488920,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,20.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488921,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,20.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488922,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,60.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488923,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,30.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488924,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,20.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488925,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,60.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488926,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,30.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488927,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1,417.10253,[M+H]+,20.0,val,Fc1ccccc1-c1c(-c2nnnn2-c2ccccc2)cnn1-c1cccc(Cl)c1
488928,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,445.10933,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488929,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,445.10933,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488930,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,445.10933,[M-H]-,60.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488931,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,445.10933,[M-H]-,30.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488932,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,445.10933,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488933,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488934,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488935,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488936,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488937,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488938,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488939,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488940,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,491.1148,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488941,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,447.12388,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488942,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,447.12388,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488943,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,447.12388,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488944,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,447.12388,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488945,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1,447.12388,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc(Cn2c(C(F)(F)F)nc3cccnc32)cc1
488946,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488947,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488948,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,60.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488949,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488950,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,45.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488951,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,60.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488952,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,20.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488953,COc1ccccc1-c1cc(=O)c2c(ccc(NC(=O)c3ccccn3)c2)o1,373.11828,[M+H]+,45.0,val,COc1ccccc1-c1cc(=O)c2cc(NC(=O)c3ccccn3)ccc2o1
488954,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488955,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488956,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488957,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488958,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488959,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,429.10677,[M-H]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488960,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,465.08344,[M+Cl]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488961,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,465.08344,[M+Cl]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488962,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,465.08344,[M+Cl]-,15.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488963,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,475.11224,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488964,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,475.11224,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488965,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,475.11224,[M+FA]-,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488966,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,475.11224,[M+FA]-,15.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488967,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,475.11224,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488968,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488969,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488970,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,45.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488971,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488972,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488973,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,45.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488974,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488975,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1,431.12132,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2)c1ccc(OC(F)(F)F)cc1
488976,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1,328.1332,[M+H]+,45.0,val,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1
488977,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1,328.1332,[M+H]+,45.0,val,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1
488978,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1,328.1332,[M+H]+,45.0,val,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1
488979,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1,328.1332,[M+H]+,20.0,val,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1
488980,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1,328.1332,[M+H]+,60.0,val,Cc1ccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c(C)c1
488981,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488982,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488983,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488984,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488985,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488986,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488987,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488988,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488989,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488990,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488991,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,463.09587,[M-H]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488992,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,463.09587,[M-H]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488993,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,463.09587,[M-H]-,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488994,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,463.09587,[M-H]-,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488995,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,463.09587,[M-H]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488996,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488997,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488998,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
488999,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489000,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,499.07255,[M+Cl]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489001,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489002,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489003,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489004,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489005,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,509.10135,[M+FA]-,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489006,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489007,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489008,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489009,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489010,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,45.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489011,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489012,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489013,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489014,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,15.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489015,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489016,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,45.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489017,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489018,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489019,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489020,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489021,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,60.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489022,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,20.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489023,Cc1cnc(-c2cnc(NCCNc3ncc(C#N)cc3)nc2-c2c(Cl)cc(Cl)cc2)[nH]1,465.11042,[M+H]+,45.0,val,Cc1cnc(-c2cnc(NCCNc3ccc(C#N)cn3)nc2-c2ccc(Cl)cc2Cl)[nH]1
489024,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,20.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489025,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,20.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489026,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,60.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489027,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,30.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489028,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,20.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489029,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,60.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489030,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,30.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489031,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1,453.12366,[M+H]+,20.0,val,Cn1c(=O)c2c(n(C)c1=O)n1c(-c3c(F)cccc3Cl)nnc1n2CCc1ccccc1
489032,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489033,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489034,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489035,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,30.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489036,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489037,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,30.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489038,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489039,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,391.13759,[M-H]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489040,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489041,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489042,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489043,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,15.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489044,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489045,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489046,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,15.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489047,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,427.11427,[M+Cl]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489048,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,437.14307,[M+FA]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489049,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,437.14307,[M+FA]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489050,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,437.14307,[M+FA]-,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489051,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,437.14307,[M+FA]-,15.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489052,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,437.14307,[M+FA]-,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489053,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489054,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489055,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,45.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489056,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489057,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489058,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,45.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489059,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,60.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489060,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1,393.15214,[M+H]+,20.0,val,N#Cc1cnc2ccc(F)cc2c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1
489061,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,522.09521,[M+FA]-,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489062,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,522.09521,[M+FA]-,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489063,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,522.09521,[M+FA]-,60.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489064,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,522.09521,[M+FA]-,15.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489065,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,522.09521,[M+FA]-,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489066,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489067,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489068,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,30.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489069,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,60.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489070,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489071,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,45.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489072,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,60.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489073,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,20.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489074,COc1c(OC)cc2c(c1)ncn2-c1cc(OCc2ccccc2C(F)(F)F)c(C(N)=O)s1,478.10429,[M+H]+,45.0,val,COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(C(N)=O)s3)c2cc1OC
489075,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489076,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489077,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,60.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489078,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,30.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489079,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489080,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,60.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489081,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,30.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489082,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,424.13907,[M-H]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489083,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,460.11575,[M+Cl]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489084,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,460.11575,[M+Cl]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489085,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,460.11575,[M+Cl]-,60.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489086,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,460.11575,[M+Cl]-,15.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489087,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,460.11575,[M+Cl]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489088,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,470.14455,[M+FA]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489089,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,470.14455,[M+FA]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489090,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,470.14455,[M+FA]-,60.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489091,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,470.14455,[M+FA]-,15.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489092,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,470.14455,[M+FA]-,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489093,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,426.15362,[M+H]+,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489094,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,426.15362,[M+H]+,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489095,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,426.15362,[M+H]+,60.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489096,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,426.15362,[M+H]+,20.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489097,N#Cc1cnc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)cc1,426.15362,[M+H]+,45.0,val,N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
489098,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489099,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489100,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,60.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489101,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,30.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489102,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489103,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,60.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489104,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,30.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489105,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,417.10269,[M-H]-,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489106,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489107,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489108,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,30.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489109,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,60.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489110,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,15.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489111,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489112,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,60.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489113,CSc1c(C(=O)Nc2cc(OCc3nnc(-c4ccccc4)o3)ccc2)cccn1,419.11724,[M+H]+,20.0,val,CSc1ncccc1C(=O)Nc1cccc(OCc2nnc(-c3ccccc3)o2)c1
489114,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489115,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489116,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,30.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489117,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489118,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,15.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489119,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489120,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489121,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489122,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,417.10269,[M-H]-,15.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489123,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489124,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489125,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489126,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,15.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489127,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489128,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489129,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489130,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,453.07936,[M+Cl]-,15.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489131,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,463.10816,[M+FA]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489132,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,463.10816,[M+FA]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489133,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,463.10816,[M+FA]-,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489134,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,463.10816,[M+FA]-,15.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489135,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,463.10816,[M+FA]-,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489136,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489137,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489138,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,45.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489139,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489140,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489141,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,45.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489142,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,60.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489143,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1,419.11724,[M+H]+,20.0,val,O=C(CSc1ccncc1)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
489144,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1,419.11724,[M+H]+,20.0,val,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1
489145,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1,419.11724,[M+H]+,20.0,val,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1
489146,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1,419.11724,[M+H]+,60.0,val,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1
489147,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1,419.11724,[M+H]+,30.0,val,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1
489148,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1,419.11724,[M+H]+,20.0,val,COc1ccc2nc(N(CCn3cccn3)C(=O)c3cc4ccccc4o3)sc2c1
489149,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,433.06695,[M-H]-,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489150,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,433.06695,[M-H]-,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489151,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,433.06695,[M-H]-,30.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489152,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,433.06695,[M-H]-,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489153,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,435.0815,[M+H]+,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489154,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,435.0815,[M+H]+,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489155,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,435.0815,[M+H]+,60.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489156,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,435.0815,[M+H]+,20.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489157,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cnccc1,435.0815,[M+H]+,60.0,val,O=C(CCc1c(-c2ccc(Br)cc2)nc2ccccn12)NCc1cccnc1
489158,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,20.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489159,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,20.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489160,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,60.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489161,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,20.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489162,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,60.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489163,Nc1c2c(-c3cc(Br)ccc3)cc(-c3cnc(N4CCOCC4)cc3)nc2ncn1,463.08765,[M+H]+,20.0,val,Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12
489164,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,20.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489165,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,20.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489166,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,60.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489167,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,15.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489168,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,20.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489169,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,60.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489170,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,15.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489171,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,441.06813,[M-H]-,20.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489172,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,443.08268,[M+H]+,30.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489173,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,443.08268,[M+H]+,30.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489174,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,443.08268,[M+H]+,20.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489175,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,443.08268,[M+H]+,60.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489176,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1,443.08268,[M+H]+,30.0,val,Cc1noc(C)c1-c1ccc(C(=O)N2[C@@H](c3ccccc3Cl)SC[C@H]2C(=O)O)cc1
489177,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489178,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489179,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,45.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489180,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,60.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489181,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489182,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,45.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489183,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,60.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489184,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,441.06813,[M-H]-,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489185,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489186,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489187,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,60.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489188,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,30.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489189,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489190,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,60.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489191,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,30.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489192,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2,443.08268,[M+H]+,20.0,val,Cc1ccc2c(c1)N(C)C(=O)c1cc(NS(=O)(=O)Cc3ccccc3Cl)ccc1O2
489193,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12,439.11333,[M+FA]-,20.0,val,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12
489194,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12,439.11333,[M+FA]-,20.0,val,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12
489195,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12,439.11333,[M+FA]-,60.0,val,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12
489196,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12,439.11333,[M+FA]-,30.0,val,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12
489197,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12,439.11333,[M+FA]-,20.0,val,CN(C(=O)COc1ccc(F)cc1)C(c1cccs1)c1c[nH]c2ccccc12
489198,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,405.13684,[M-H]-,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489199,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,405.13684,[M-H]-,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489200,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,405.13684,[M-H]-,30.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489201,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,405.13684,[M-H]-,60.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489202,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,405.13684,[M-H]-,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489203,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489204,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489205,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,60.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489206,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489207,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,45.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489208,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,60.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489209,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,20.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489210,O=C1OC2(CCC(C(=O)Nc3nn(-c4ccccc4F)cc3)CC2)c2c1ccnc2,407.15139,[M+H]+,45.0,val,O=C1OC2(CCC(C(=O)Nc3ccn(-c4ccccc4F)n3)CC2)c2cnccc21
489211,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489212,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489213,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,60.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489214,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,30.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489215,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489216,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,60.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489217,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,30.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489218,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,384.1466,[M-H]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489219,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,420.12328,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489220,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,420.12328,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489221,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,420.12328,[M+Cl]-,60.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489222,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,420.12328,[M+Cl]-,15.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489223,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,420.12328,[M+Cl]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489224,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,430.15208,[M+FA]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489225,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,430.15208,[M+FA]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489226,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,430.15208,[M+FA]-,60.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489227,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,430.15208,[M+FA]-,15.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489228,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,430.15208,[M+FA]-,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489229,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,386.16115,[M+H]+,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489230,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,386.16115,[M+H]+,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489231,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,386.16115,[M+H]+,60.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489232,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,386.16115,[M+H]+,30.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489233,Cc1c(-n2ncc(C(=O)c3cccc(C#N)c3)c2N)cc(C(=O)NC2CC2)cc1,386.16115,[M+H]+,20.0,val,Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(C#N)c2)c1N
489234,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,384.1466,[M-H]-,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489235,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,384.1466,[M-H]-,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489236,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,384.1466,[M-H]-,60.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489237,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,384.1466,[M-H]-,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489238,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,384.1466,[M-H]-,45.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489239,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489240,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489241,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,60.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489242,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489243,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,60.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489244,c1ccc(-c2nn3c(Nc4cc5c(cc4)OCO5)c4CCCCc4nc3n2)cc1,386.16115,[M+H]+,20.0,val,c1ccc(-c2nc3nc4c(c(Nc5ccc6c(c5)OCO6)n3n2)CCCC4)cc1
489245,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489246,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489247,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489248,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,30.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489249,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489250,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,30.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489251,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489252,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,384.1466,[M-H]-,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489253,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,420.12328,[M+Cl]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489254,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,420.12328,[M+Cl]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489255,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,420.12328,[M+Cl]-,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489256,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,420.12328,[M+Cl]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489257,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,430.15208,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489258,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,430.15208,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489259,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,430.15208,[M+FA]-,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489260,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,430.15208,[M+FA]-,15.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489261,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,430.15208,[M+FA]-,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489262,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489263,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489264,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489265,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,30.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489266,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489267,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,30.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489268,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,60.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489269,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1,386.16115,[M+H]+,20.0,val,O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cc(-c2ccccc2)n[nH]1
489270,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1,474.05467,[M+H]+,20.0,val,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1
489271,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1,474.05467,[M+H]+,20.0,val,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1
489272,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1,474.05467,[M+H]+,60.0,val,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1
489273,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1,474.05467,[M+H]+,30.0,val,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1
489274,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1,474.05467,[M+H]+,20.0,val,COC(=O)C1=C(N)OC2=C(C(=O)CCC2)C1c1ccc(COc2ccccc2Br)o1
489275,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,409.09923,[M-H]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489276,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,409.09923,[M-H]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489277,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,409.09923,[M-H]-,60.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489278,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,409.09923,[M-H]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489279,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,409.09923,[M-H]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489280,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,445.0759,[M+Cl]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489281,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,445.0759,[M+Cl]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489282,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,445.0759,[M+Cl]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489283,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,445.0759,[M+Cl]-,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489284,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,411.11378,[M+H]+,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489285,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,411.11378,[M+H]+,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489286,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,411.11378,[M+H]+,60.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489287,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,411.11378,[M+H]+,20.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489288,Clc1c(Cl)cc(Nc2c3[nH]c(C4CCCCC4)nc3c3ccccc3n2)cc1,411.11378,[M+H]+,75.0,val,Clc1ccc(Nc2nc3ccccc3c3nc(C4CCCCC4)[nH]c23)cc1Cl
489289,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,473.07888,[M-H]-,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489290,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,473.07888,[M-H]-,60.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489291,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,473.07888,[M-H]-,30.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489292,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,473.07888,[M-H]-,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489293,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cc(Cl)ccc1)n2Cc1ccc(Cl)cc1,475.09344,[M+H]+,20.0,val,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(Cl)c1)n2Cc1ccc(Cl)cc1
489294,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cc(Cl)ccc1)n2Cc1ccc(Cl)cc1,475.09344,[M+H]+,20.0,val,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(Cl)c1)n2Cc1ccc(Cl)cc1
489295,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cc(Cl)ccc1)n2Cc1ccc(Cl)cc1,475.09344,[M+H]+,60.0,val,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(Cl)c1)n2Cc1ccc(Cl)cc1
489296,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cc(Cl)ccc1)n2Cc1ccc(Cl)cc1,475.09344,[M+H]+,30.0,val,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(Cl)c1)n2Cc1ccc(Cl)cc1
489297,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cc(Cl)ccc1)n2Cc1ccc(Cl)cc1,475.09344,[M+H]+,20.0,val,Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(Cl)c1)n2Cc1ccc(Cl)cc1
489298,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489299,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489300,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,60.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489301,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,15.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489302,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489303,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,60.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489304,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,15.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489305,Cc1c([N+](=O)[O-])c(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)no1,475.09344,[M+H]+,20.0,val,Cc1onc(C(=O)N2CCN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]
489306,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,557.08788,[M+FA]-,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489307,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,557.08788,[M+FA]-,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489308,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,557.08788,[M+FA]-,60.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489309,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,557.08788,[M+FA]-,15.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489310,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,557.08788,[M+FA]-,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489311,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489312,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489313,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,60.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489314,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,15.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489315,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489316,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,45.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489317,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,60.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489318,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)c(Cl)cc3)CC2)cc1,513.09695,[M+H]+,20.0,val,Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1
489319,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,20.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489320,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,20.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489321,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,60.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489322,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,30.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489323,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,20.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489324,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,60.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489325,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,30.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489326,Cc1ccccc1CN(c1ccc(C(=O)Nc2c(F)cc(F)cc2)cc1)S(C)(=O)=O,429.10899,[M-H]-,20.0,val,Cc1ccccc1CN(c1ccc(C(=O)Nc2ccc(F)cc2F)cc1)S(C)(=O)=O
489327,Cc1cc(C(=O)N2CCCC(c3nc(-c4cc(F)ccc4)no3)C2)c2[nH]ncc2c1,406.16738,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCCC(c3nc(-c4cccc(F)c4)no3)C2)c2[nH]ncc2c1
489328,Cc1cc(C(=O)N2CCCC(c3nc(-c4cc(F)ccc4)no3)C2)c2[nH]ncc2c1,406.16738,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCCC(c3nc(-c4cccc(F)c4)no3)C2)c2[nH]ncc2c1
489329,Cc1cc(C(=O)N2CCCC(c3nc(-c4cc(F)ccc4)no3)C2)c2[nH]ncc2c1,406.16738,[M+H]+,60.0,val,Cc1cc(C(=O)N2CCCC(c3nc(-c4cccc(F)c4)no3)C2)c2[nH]ncc2c1
489330,Cc1cc(C(=O)N2CCCC(c3nc(-c4cc(F)ccc4)no3)C2)c2[nH]ncc2c1,406.16738,[M+H]+,15.0,val,Cc1cc(C(=O)N2CCCC(c3nc(-c4cccc(F)c4)no3)C2)c2[nH]ncc2c1
489331,Cc1cc(C(=O)N2CCCC(c3nc(-c4cc(F)ccc4)no3)C2)c2[nH]ncc2c1,406.16738,[M+H]+,20.0,val,Cc1cc(C(=O)N2CCCC(c3nc(-c4cccc(F)c4)no3)C2)c2[nH]ncc2c1
489332,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,404.15283,[M-H]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489333,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,404.15283,[M-H]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489334,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,404.15283,[M-H]-,60.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489335,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,404.15283,[M-H]-,30.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489336,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,404.15283,[M-H]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489337,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,450.15831,[M+FA]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489338,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,450.15831,[M+FA]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489339,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,450.15831,[M+FA]-,60.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489340,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,450.15831,[M+FA]-,15.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489341,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,450.15831,[M+FA]-,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489342,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489343,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489344,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,60.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489345,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,30.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489346,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489347,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,60.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489348,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,30.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489349,Nc1c2nc(-c3cc(F)ccc3)ccc2c(C(=O)NC2CN(C(=O)C3CC3)C2)cn1,406.16738,[M+H]+,20.0,val,Nc1ncc(C(=O)NC2CN(C(=O)C3CC3)C2)c2ccc(-c3cccc(F)c3)nc12
489350,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,404.15283,[M-H]-,30.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489351,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,404.15283,[M-H]-,30.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489352,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,404.15283,[M-H]-,20.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489353,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,404.15283,[M-H]-,60.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489354,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,404.15283,[M-H]-,30.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489355,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,405.1601,[M]+,30.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489356,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,405.1601,[M]+,60.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489357,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,405.1601,[M]+,30.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489358,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,406.16738,[M+H]+,20.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489359,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,406.16738,[M+H]+,20.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489360,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,406.16738,[M+H]+,60.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489361,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,406.16738,[M+H]+,20.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489362,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3c2c(F)ccc3)C1,406.16738,[M+H]+,45.0,val,O=C(NCCc1c[nH]c2ccccc12)C1CC(=O)N(c2n[nH]c3cccc(F)c23)C1
489363,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,20.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489364,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,20.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489365,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,45.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489366,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,60.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489367,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,20.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489368,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,45.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489369,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,60.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489370,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1,406.14962,[M+H]+,20.0,val,Cc1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1-c1ccc(F)cc1
489371,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,359.12236,[M-H]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489372,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,359.12236,[M-H]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489373,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,359.12236,[M-H]-,15.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489374,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,359.12236,[M-H]-,60.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489375,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,359.12236,[M-H]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489376,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489377,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489378,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,60.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489379,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,15.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489380,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489381,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,60.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489382,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,15.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489383,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,405.12784,[M+FA]-,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489384,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,361.13691,[M+H]+,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489385,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,361.13691,[M+H]+,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489386,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,361.13691,[M+H]+,60.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489387,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,361.13691,[M+H]+,30.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489388,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21,361.13691,[M+H]+,20.0,val,O=C(NCc1ccccc1)NC1c2ccccc2CSc2ccccc21
489389,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1,421.15065,[M+H]+,20.0,val,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1
489390,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1,421.15065,[M+H]+,20.0,val,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1
489391,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1,421.15065,[M+H]+,60.0,val,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1
489392,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1,421.15065,[M+H]+,15.0,val,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1
489393,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1,421.15065,[M+H]+,20.0,val,COc1ccc(OC)c(-c2noc(Cn3c(=O)n(C4CC4)c(=O)c4ccccc43)n2)c1
489394,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489395,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489396,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,60.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489397,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489398,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,45.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489399,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,60.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489400,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489401,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,383.16258,[M-H]-,45.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489402,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,429.16806,[M+FA]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489403,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,429.16806,[M+FA]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489404,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,429.16806,[M+FA]-,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489405,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,385.17713,[M+H]+,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489406,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,385.17713,[M+H]+,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489407,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,385.17713,[M+H]+,60.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489408,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,385.17713,[M+H]+,20.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489409,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1,385.17713,[M+H]+,45.0,val,Cc1nc(Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc(-n2ccnc2)n1
489410,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,20.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489411,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,20.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489412,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,45.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489413,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,60.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489414,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,20.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489415,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,20.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489416,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,45.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489417,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1,385.17713,[M+H]+,60.0,val,O=c1cc(N2CCN(c3cnc4ccccc4n3)CC2)c(-c2ccccc2)n[nH]1
489418,Cc1ccc(C(=O)C(CC(=O)c2cscc2)S(=O)(=O)c2ccc(C)cc2)cc1,413.08758,[M+H]+,20.0,val,Cc1ccc(C(=O)C(CC(=O)c2ccsc2)S(=O)(=O)c2ccc(C)cc2)cc1
489419,Cc1ccc(C(=O)C(CC(=O)c2cscc2)S(=O)(=O)c2ccc(C)cc2)cc1,413.08758,[M+H]+,20.0,val,Cc1ccc(C(=O)C(CC(=O)c2ccsc2)S(=O)(=O)c2ccc(C)cc2)cc1
489420,Cc1ccc(C(=O)C(CC(=O)c2cscc2)S(=O)(=O)c2ccc(C)cc2)cc1,413.08758,[M+H]+,60.0,val,Cc1ccc(C(=O)C(CC(=O)c2ccsc2)S(=O)(=O)c2ccc(C)cc2)cc1
489421,Cc1ccc(C(=O)C(CC(=O)c2cscc2)S(=O)(=O)c2ccc(C)cc2)cc1,413.08758,[M+H]+,15.0,val,Cc1ccc(C(=O)C(CC(=O)c2ccsc2)S(=O)(=O)c2ccc(C)cc2)cc1
489422,Cc1ccc(C(=O)C(CC(=O)c2cscc2)S(=O)(=O)c2ccc(C)cc2)cc1,413.08758,[M+H]+,20.0,val,Cc1ccc(C(=O)C(CC(=O)c2ccsc2)S(=O)(=O)c2ccc(C)cc2)cc1
489423,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489424,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489425,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,60.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489426,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489427,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,60.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489428,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,439.1001,[M-H]-,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489429,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489430,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489431,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,45.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489432,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,60.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489433,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489434,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,60.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489435,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,45.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489436,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1,441.11465,[M+H]+,20.0,val,O=C(Nc1nc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cs1)c1ccccc1
489437,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1,441.11465,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1
489438,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1,441.11465,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1
489439,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1,441.11465,[M+H]+,60.0,val,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1
489440,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1,441.11465,[M+H]+,30.0,val,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1
489441,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1,441.11465,[M+H]+,20.0,val,COc1ccc(Cl)cc1NC(=O)CSc1nccc(N2CCc3ccccc3C2)n1
489442,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489443,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489444,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,60.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489445,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,30.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489446,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489447,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,60.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489448,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,30.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489449,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,455.09501,[M-H]-,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489450,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,491.07169,[M+Cl]-,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489451,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,491.07169,[M+Cl]-,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489452,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,491.07169,[M+Cl]-,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489453,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,491.07169,[M+Cl]-,60.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489454,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,491.07169,[M+Cl]-,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489455,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,457.10956,[M+H]+,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489456,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,457.10956,[M+H]+,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489457,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,457.10956,[M+H]+,20.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489458,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,457.10956,[M+H]+,60.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489459,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1,457.10956,[M+H]+,15.0,val,COc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c2nc(SC)ncc2Cl)cc1
489460,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489461,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489462,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489463,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489464,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,45.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489465,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489466,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489467,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489468,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489469,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489470,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489471,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489472,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489473,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489474,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489475,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,15.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489476,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489477,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489478,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,15.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489479,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489480,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489481,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489482,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489483,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489484,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489485,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489486,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489487,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489488,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489489,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489490,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489491,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489492,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,465.11014,[M-H]-,45.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489493,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489494,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489495,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489496,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489497,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,501.08681,[M+Cl]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489498,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489499,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489500,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489501,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,15.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489502,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489503,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489504,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,15.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489505,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,511.11562,[M+FA]-,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489506,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489507,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489508,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489509,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489510,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489511,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,60.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489512,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,30.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489513,Cc1c(-c2ccccc2C(F)(F)F)n(CCO)cc1C(=O)Nc1ccc(S(C)(=O)=O)cc1,467.12469,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cn(CCO)c1-c1ccccc1C(F)(F)F
489514,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489515,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489516,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,60.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489517,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,30.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489518,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489519,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,30.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489520,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489521,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,429.15438,[M-H]-,60.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489522,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,465.13106,[M+Cl]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489523,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,465.13106,[M+Cl]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489524,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,465.13106,[M+Cl]-,60.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489525,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,465.13106,[M+Cl]-,15.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489526,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,465.13106,[M+Cl]-,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489527,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,429.15438,[M-H]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489528,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,429.15438,[M-H]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489529,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,429.15438,[M-H]-,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489530,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,429.15438,[M-H]-,30.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489531,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,429.15438,[M-H]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489532,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,465.13106,[M+Cl]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489533,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,465.13106,[M+Cl]-,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489534,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489535,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489536,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489537,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,15.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489538,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489539,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489540,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489541,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,475.15986,[M+FA]-,15.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489542,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489543,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489544,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,60.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489545,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,30.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489546,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489547,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,30.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489548,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,20.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489549,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1,431.16894,[M+H]+,60.0,val,Cc1cccc(C2=NC3(CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)NC2=O)c1
489550,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489551,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489552,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489553,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,15.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489554,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489555,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,20.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489556,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,15.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489557,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1,431.16894,[M+H]+,60.0,val,Cc1ccc(-c2ccc(=O)n(CCCNC(=O)Nc3cccc(C(F)(F)F)c3)n2)cc1
489558,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489559,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489560,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,60.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489561,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489562,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,45.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489563,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,60.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489564,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489565,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,445.1493,[M-H]-,45.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489566,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,481.12598,[M+Cl]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489567,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,481.12598,[M+Cl]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489568,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,481.12598,[M+Cl]-,60.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489569,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,481.12598,[M+Cl]-,15.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489570,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,491.15478,[M+FA]-,15.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489571,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,491.15478,[M+FA]-,15.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489572,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,491.15478,[M+FA]-,60.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489573,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,491.15478,[M+FA]-,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489574,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,491.15478,[M+FA]-,15.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489575,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,447.16385,[M+H]+,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489576,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,447.16385,[M+H]+,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489577,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,447.16385,[M+H]+,60.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489578,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,447.16385,[M+H]+,15.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489579,O=C(NCc1ccco1)c1n[nH]c(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3)CC2)c1,447.16385,[M+H]+,20.0,val,O=C(NCc1ccco1)c1cc(C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)[nH]n1
489580,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,445.1493,[M-H]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489581,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,445.1493,[M-H]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489582,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,445.1493,[M-H]-,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489583,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,445.1493,[M-H]-,30.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489584,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,445.1493,[M-H]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489585,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489586,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489587,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489588,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,15.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489589,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489590,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489591,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489592,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,491.15478,[M+FA]-,15.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489593,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489594,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489595,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,45.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489596,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489597,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489598,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,45.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489599,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489600,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,445.1493,[M-H]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489601,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,481.12598,[M+Cl]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489602,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,481.12598,[M+Cl]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489603,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,481.12598,[M+Cl]-,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489604,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,491.15478,[M+FA]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489605,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,491.15478,[M+FA]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489606,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,491.15478,[M+FA]-,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489607,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,491.15478,[M+FA]-,30.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489608,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,491.15478,[M+FA]-,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489609,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489610,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489611,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489612,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,15.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489613,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489614,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,15.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489615,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489616,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1,447.16385,[M+H]+,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Nc3ccc(C(F)(F)F)cc3)n2)cc1
489617,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489618,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489619,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489620,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,30.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489621,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489622,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,30.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489623,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,20.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489624,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1,447.16385,[M+H]+,60.0,val,COc1ccc(C(F)(F)F)cc1NC(=O)C1CCCN(c2ccc(-c3ccco3)nn2)C1
489625,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,411.13617,[M-H]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489626,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,411.13617,[M-H]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489627,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,411.13617,[M-H]-,60.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489628,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,411.13617,[M-H]-,30.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489629,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,411.13617,[M-H]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489630,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,457.14165,[M+FA]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489631,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,457.14165,[M+FA]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489632,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,457.14165,[M+FA]-,60.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489633,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,457.14165,[M+FA]-,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489634,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489635,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489636,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,45.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489637,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,60.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489638,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489639,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,60.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489640,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,45.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489641,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12,413.15073,[M+H]+,20.0,val,CCOC(=O)COc1cc(-c2ccc(F)cc2)nc2ccc(NC(=O)COC)cc12
489642,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489643,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489644,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,60.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489645,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,30.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489646,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489647,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,30.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489648,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,60.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489649,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,434.12923,[M-H]-,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489650,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489651,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489652,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,60.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489653,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,30.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489654,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489655,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,30.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489656,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489657,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,60.0,val,Cc1c(C(=O)CSc2n[nH]c(COc3ccccc3)n2)c(=O)n(-c2ccccc2)n1C
489658,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489659,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489660,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,60.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489661,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,30.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489662,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489663,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,30.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489664,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,20.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489665,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C,436.14379,[M+H]+,60.0,val,Cc1c(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(=O)n(-c2ccccc2)n1C
489666,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489667,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489668,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489669,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,30.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489670,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489671,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489672,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,426.10168,[M-H]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489673,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,462.07836,[M+Cl]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489674,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,462.07836,[M+Cl]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489675,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,462.07836,[M+Cl]-,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489676,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,462.07836,[M+Cl]-,15.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489677,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,462.07836,[M+Cl]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489678,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,472.10716,[M+FA]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489679,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,472.10716,[M+FA]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489680,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,472.10716,[M+FA]-,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489681,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,472.10716,[M+FA]-,15.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489682,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,472.10716,[M+FA]-,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489683,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489684,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489685,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489686,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,30.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489687,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489688,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,60.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489689,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,30.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489690,CC1(NC(=O)COc2cc3c(cc2)c(-c2ccccc2)cc(=O)o3)CCS(=O)(=O)C1,428.11623,[M+H]+,20.0,val,CC1(NC(=O)COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)CCS(=O)(=O)C1
489691,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489692,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489693,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,60.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489694,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,15.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489695,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489696,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489697,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,60.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489698,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,488.123,[M+FA]-,15.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489699,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489700,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489701,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,60.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489702,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,30.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489703,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489704,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,30.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489705,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,60.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489706,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC,444.13207,[M+H]+,20.0,val,COc1cc(C(=O)NCCn2nc(-c3ccc(Cl)cc3)ccc2=O)cc(OC)c1OC
489707,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489708,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489709,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489710,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489711,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489712,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489713,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489714,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489715,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489716,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489717,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489718,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489719,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489720,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489721,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489722,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489723,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489724,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489725,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489726,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489727,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489728,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489729,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489730,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489731,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489732,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489733,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489734,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489735,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489736,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,60.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489737,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,15.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489738,C[C@@H](NCCCc1cc(C(F)(F)F)ccc1)c1cccc2ccccc12,358.17771,[M+H]+,20.0,val,C[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12
489739,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489740,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489741,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,60.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489742,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,30.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489743,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489744,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,60.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489745,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,30.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489746,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,448.13121,[M-H]-,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489747,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,450.14576,[M+H]+,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489748,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,450.14576,[M+H]+,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489749,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,450.14576,[M+H]+,60.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489750,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,450.14576,[M+H]+,15.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489751,COc1ccc(CNC(=O)CSc2nc3c(CCCCC3)c(C(F)(F)F)c2C#N)cc1,450.14576,[M+H]+,20.0,val,COc1ccc(CNC(=O)CSc2nc3c(c(C(F)(F)F)c2C#N)CCCCC3)cc1
489752,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489753,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489754,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,60.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489755,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,15.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489756,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489757,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,60.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489758,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,15.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489759,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,478.15953,[M+FA]-,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489760,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489761,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489762,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,60.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489763,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489764,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,60.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489765,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F,434.1686,[M+H]+,20.0,val,Cc1c(Cn2c(C)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F
489766,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489767,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489768,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489769,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489770,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489771,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,432.15405,[M-H]-,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489772,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489773,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489774,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489775,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,30.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489776,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489777,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,60.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489778,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,30.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489779,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2,434.1686,[M+H]+,20.0,val,Cn1c2c(c(=O)n(C)c1=O)C(c1ccc(C(F)(F)F)cc1)C1=C(CC(C)(C)CC1=O)N2
489780,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1,412.14895,[M+H]+,20.0,val,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1
489781,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1,412.14895,[M+H]+,20.0,val,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1
489782,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1,412.14895,[M+H]+,60.0,val,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1
489783,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1,412.14895,[M+H]+,15.0,val,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1
489784,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1,412.14895,[M+H]+,20.0,val,O=C(NCCOc1ccc(-c2ccc(F)cc2)nn1)C1(c2cccs2)CCCC1
489785,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1,423.14854,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1
489786,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1,423.14854,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1
489787,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1,423.14854,[M+H]+,60.0,val,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1
489788,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1,423.14854,[M+H]+,30.0,val,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1
489789,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1,423.14854,[M+H]+,20.0,val,O=C1CC(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)CN1CCc1cccs1
489790,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,405.15683,[M-H]-,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489791,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,405.15683,[M-H]-,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489792,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,405.15683,[M-H]-,60.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489793,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,405.15683,[M-H]-,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489794,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,405.15683,[M-H]-,45.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489795,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,407.17138,[M+H]+,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489796,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,407.17138,[M+H]+,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489797,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,407.17138,[M+H]+,60.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489798,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,407.17138,[M+H]+,30.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489799,COc1c2c(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c[nH]c2ncc1,407.17138,[M+H]+,20.0,val,COc1ccnc2[nH]cc(C(=O)C(=O)N3CCN(C(=O)c4ccccc4)C[C@H]3C)c12
489800,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489801,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489802,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489803,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,30.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489804,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489805,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489806,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,30.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489807,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O,407.17138,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)C(=O)O
489808,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O,405.15683,[M-H]-,20.0,val,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O
489809,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O,405.15683,[M-H]-,20.0,val,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O
489810,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O,405.15683,[M-H]-,60.0,val,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O
489811,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O,405.15683,[M-H]-,30.0,val,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O
489812,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O,405.15683,[M-H]-,20.0,val,COc1ccccc1CNC(=O)Cn1nc(C(=O)Nc2ccc(C)cc2)ccc1=O
489813,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489814,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489815,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,45.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489816,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,60.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489817,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489818,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,60.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489819,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,389.14416,[M-H]-,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489820,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489821,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489822,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,45.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489823,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,60.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489824,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489825,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,20.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489826,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,60.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489827,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1,391.15871,[M+H]+,45.0,val,CCCc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C=NCCc1ccccc1
489828,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,445.15645,[M-H]-,20.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489829,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,445.15645,[M-H]-,20.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489830,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,447.171,[M+H]+,20.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489831,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,447.171,[M+H]+,20.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489832,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,447.171,[M+H]+,60.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489833,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,447.171,[M+H]+,30.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489834,Cc1ccc(NC(=O)N2CCN(c3c4nc(-c5cnccc5)sc4nc(N)n3)CC2)cc1,447.171,[M+H]+,20.0,val,Cc1ccc(NC(=O)N2CCN(c3nc(N)nc4sc(-c5cccnc5)nc34)CC2)cc1
489835,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1,481.0907,[M+Cl]-,20.0,val,COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489836,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1,481.0907,[M+Cl]-,20.0,val,COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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489864,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489865,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489866,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489867,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489868,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489869,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489870,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
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489891,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489892,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489893,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489894,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489895,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489896,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489897,OC[C@H]1O[C@@H](Oc2cc3c(cc2)[C@@H]2Oc4cc5c(cc4[C@@H]2CO3)OCO5)[C@H](O)[C@@H](O)[C@@H]1O,491.1195,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@H]2c4cc5c(cc4O[C@@H]32)OCO5)[C@H](O)[C@@H](O)[C@@H]1O
489898,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489899,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489900,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489901,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489902,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489903,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489904,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489905,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489906,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489907,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489908,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489909,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489910,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,45.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489911,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489912,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489913,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489914,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,15.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489915,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489916,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489917,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,15.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489918,COc1c2c(=O)c(-c3ccc(O)cc3)coc2cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,447.12857,[M+H]+,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2occ(-c3ccc(O)cc3)c(=O)c12
489919,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489920,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489921,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489922,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489923,COc1c2oc(-c3ccccc3)cc(=O)c2c(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
489924,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,481.0907,[M+Cl]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489925,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,481.0907,[M+Cl]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489926,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,481.0907,[M+Cl]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489927,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489928,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489929,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489930,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489931,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489932,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489933,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489934,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,491.1195,[M+FA]-,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489935,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489936,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489937,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,445.11402,[M-H]-,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489938,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,445.11402,[M-H]-,30.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489939,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,445.11402,[M-H]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489940,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,481.0907,[M+Cl]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489941,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,481.0907,[M+Cl]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489942,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,481.0907,[M+Cl]-,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489943,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,481.0907,[M+Cl]-,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489944,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,481.0907,[M+Cl]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489945,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489946,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489947,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489948,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489949,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489950,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489951,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489952,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,491.1195,[M+FA]-,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489953,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,445.11402,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489954,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,445.11402,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489955,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,445.11402,[M-H]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489956,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,445.11402,[M-H]-,30.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489957,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,445.11402,[M-H]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489958,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489959,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489960,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,491.1195,[M+FA]-,60.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489961,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,491.1195,[M+FA]-,15.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489962,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O,491.1195,[M+FA]-,20.0,val,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
489963,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489964,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489965,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,60.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489966,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489967,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,60.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489968,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,445.11402,[M-H]-,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489969,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489970,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489971,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489972,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489973,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489974,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,60.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489975,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,15.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489976,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O,447.12857,[M+H]+,20.0,val,COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccccc3)cc(=O)c2c1O
489977,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489978,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489979,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489980,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489981,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489982,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,20.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489983,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,60.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489984,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,447.12857,[M+H]+,15.0,val,COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1
489985,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489986,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489987,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,60.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489988,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,15.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489989,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,447.12857,[M+H]+,20.0,val,COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
489990,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,399.14383,[M+H]+,20.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489991,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,399.14383,[M+H]+,20.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489992,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,399.14383,[M+H]+,60.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489993,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,399.14383,[M+H]+,15.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489994,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,399.14383,[M+H]+,20.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489995,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,421.12577,[M+Na]+,20.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489996,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cc3c(cc2)OCCO3)cc1,421.12577,[M+Na]+,20.0,val,CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1
489997,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1,397.12928,[M-H]-,20.0,val,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1
489998,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1,397.12928,[M-H]-,20.0,val,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1
489999,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1,397.12928,[M-H]-,60.0,val,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1
490000,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1,397.12928,[M-H]-,30.0,val,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1
490001,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1,397.12928,[M-H]-,20.0,val,COc1ccc(/C=C/C(=O)OCC(O)COC(=O)/C=C/c2ccc(O)cc2)cc1
490002,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,381.13327,[M+H-H2O]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490003,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,381.13327,[M+H-H2O]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490004,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,381.13327,[M+H-H2O]+,60.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490005,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,381.13327,[M+H-H2O]+,30.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490006,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,381.13327,[M+H-H2O]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490007,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,399.14383,[M+H]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490008,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,399.14383,[M+H]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490009,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,399.14383,[M+H]+,60.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490010,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,399.14383,[M+H]+,15.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490011,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O,399.14383,[M+H]+,20.0,val,COC1C=C(COC(=O)c2ccccc2)C(O)C(OC(=O)c2ccccc2)C1O
490012,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490013,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490014,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,15.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490015,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,60.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490016,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,30.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490017,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490018,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,60.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490019,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,399.14383,[M+H]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490020,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,416.17038,[M+NH4]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490021,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,416.17038,[M+NH4]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490022,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,416.17038,[M+NH4]+,60.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490023,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,416.17038,[M+NH4]+,15.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490024,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,416.17038,[M+NH4]+,20.0,val,COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
490025,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,527.10479,[M+FA]-,15.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490026,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,527.10479,[M+FA]-,15.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490027,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,527.10479,[M+FA]-,15.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490028,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,483.11386,[M+H]+,20.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490029,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,483.11386,[M+H]+,20.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490030,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,483.11386,[M+H]+,60.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490031,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,483.11386,[M+H]+,20.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490032,Nc1c(Br)cc2ccc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)cc2n1,483.11386,[M+H]+,45.0,val,Nc1nc2cc(CC[C@H]3C[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@@H]3O)ccc2cc1Br
490033,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,454.13192,[M-H]-,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490034,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,454.13192,[M-H]-,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490035,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,454.13192,[M-H]-,20.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490036,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,454.13192,[M-H]-,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490037,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,454.13192,[M-H]-,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490038,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,20.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490039,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,20.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490040,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490041,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,20.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490042,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,45.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490043,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,60.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490044,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,20.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490045,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1,456.14648,[M+H]+,45.0,val,Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
490046,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,20.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490047,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,20.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490048,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,60.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490049,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,15.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490050,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,20.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490051,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,60.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490052,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,15.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490053,Cc1nn(-c2c(CO)cccn2)cc1CN1CCC2(CC1)OCC(F)(F)c1c2sc(Cl)c1,481.12711,[M+H]+,20.0,val,Cc1nn(-c2ncccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12
490054,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,409.14368,[M-H]-,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490055,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,409.14368,[M-H]-,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490056,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,409.14368,[M-H]-,60.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490057,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,409.14368,[M-H]-,15.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490058,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,409.14368,[M-H]-,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490059,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,455.14916,[M+FA]-,15.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490060,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,455.14916,[M+FA]-,15.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490061,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,455.14916,[M+FA]-,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490062,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,455.14916,[M+FA]-,60.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490063,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,455.14916,[M+FA]-,15.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490064,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490065,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490066,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,60.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490067,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490068,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,45.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490069,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,60.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490070,Cc1nccn1-c1c(CNC(=O)C2(c3ccccc3Cl)CCOCC2)cccn1,411.15823,[M+H]+,20.0,val,Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccccc2Cl)CCOCC1
490071,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1,439.16438,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1
490072,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1,439.16438,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1
490073,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1,439.16438,[M+H]+,60.0,val,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1
490074,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1,439.16438,[M+H]+,30.0,val,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1
490075,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1,439.16438,[M+H]+,20.0,val,O=C(NC1CCN(c2nnc3ccc(Cl)cn23)CC1)c1ccc(N2CCCC2=O)cc1
490076,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,437.14983,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490077,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,437.14983,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490078,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,437.14983,[M-H]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490079,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,437.14983,[M-H]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490080,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,437.14983,[M-H]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490081,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,473.1265,[M+Cl]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490082,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,483.1553,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490083,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,483.1553,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490084,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,483.1553,[M+FA]-,60.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490085,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,483.1553,[M+FA]-,15.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490086,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,483.1553,[M+FA]-,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490087,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,439.16438,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490088,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,439.16438,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490089,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,439.16438,[M+H]+,60.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490090,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,439.16438,[M+H]+,15.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490091,COc1cc2c(cc1)[nH]cc2CCNC(=O)CC(Cn1cnnn1)c1ccc(Cl)cc1,439.16438,[M+H]+,20.0,val,COc1ccc2[nH]cc(CCNC(=O)CC(Cn3cnnn3)c3ccc(Cl)cc3)c2c1
490092,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,431.17003,[M-H]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490093,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,431.17003,[M-H]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490094,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,431.17003,[M-H]-,45.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490095,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,431.17003,[M-H]-,60.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490096,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,431.17003,[M-H]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490097,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,467.14671,[M+Cl]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490098,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,467.14671,[M+Cl]-,15.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490099,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490100,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490101,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,60.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490102,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,15.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490103,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490104,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,60.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490105,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,15.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490106,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,477.17551,[M+FA]-,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490107,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,433.18459,[M+H]+,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490108,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,433.18459,[M+H]+,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490109,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,433.18459,[M+H]+,45.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490110,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,433.18459,[M+H]+,60.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490111,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F,433.18459,[M+H]+,20.0,val,Cc1cc(-c2nnc(C3CCC3)o2)c(C)n1CC(=O)NCc1ccccc1C(F)(F)F
490112,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,483.17977,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490113,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,483.17977,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490114,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,483.17977,[M+FA]-,60.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490115,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,483.17977,[M+FA]-,15.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490116,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,483.17977,[M+FA]-,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490117,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,439.18884,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490118,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,439.18884,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490119,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,439.18884,[M+H]+,60.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490120,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,439.18884,[M+H]+,15.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490121,CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccc(CNCc4n[nH]nc4)cc3)cc2)C(=O)O1,439.18884,[M+H]+,20.0,val,CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CNCc4cn[nH]n4)cc3)c(F)c2)C(=O)O1
490122,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490123,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490124,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,60.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490125,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,30.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490126,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490127,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,30.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490128,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,60.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490129,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1,439.18884,[M+H]+,20.0,val,COc1ccc(-c2ncnc(N3CCN(C(=O)Cn4cnc(C)cc4=O)CC3)c2F)cc1
490130,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,469.16412,[M-H]-,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490131,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,469.16412,[M-H]-,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490132,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,469.16412,[M-H]-,60.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490133,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,469.16412,[M-H]-,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490134,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,469.16412,[M-H]-,45.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490135,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490136,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490137,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,60.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490138,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490139,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,45.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490140,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,60.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490141,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,20.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490142,COc1cc(Nc2ncc(F)c(Nc3nc4c(cc3)OC(C)(C)C(=O)N4)n2)cc(OC)c1OC,471.17867,[M+H]+,45.0,val,COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC
490143,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,408.1565,[M-H]-,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490144,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,408.1565,[M-H]-,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490145,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,408.1565,[M-H]-,60.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490146,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,408.1565,[M-H]-,30.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490147,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,408.1565,[M-H]-,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490148,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,392.16049,[M+H-H2O]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490149,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,392.16049,[M+H-H2O]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490150,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,392.16049,[M+H-H2O]+,60.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490151,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,392.16049,[M+H-H2O]+,15.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490152,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,392.16049,[M+H-H2O]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490153,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,410.17105,[M+H]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490154,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,410.17105,[M+H]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490155,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,410.17105,[M+H]+,60.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490156,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,410.17105,[M+H]+,15.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490157,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O,410.17105,[M+H]+,20.0,val,COC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O
490158,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490159,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490160,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,60.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490161,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,15.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490162,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490163,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490164,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,60.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490165,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1,410.17105,[M+H]+,15.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)c3c(OC)cccc3OC)n2)cc1
490166,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1,410.17105,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1
490167,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1,410.17105,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1
490168,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1,410.17105,[M+H]+,60.0,val,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1
490169,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1,410.17105,[M+H]+,15.0,val,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1
490170,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1,410.17105,[M+H]+,20.0,val,COC(=O)c1ccc2c(=O)n(Cc3ccc(OC)cc3)c(N3CCOCC3)nc2c1
490171,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,20.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490172,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,20.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490173,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,60.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490174,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,30.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490175,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,20.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490176,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,30.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490177,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,60.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490178,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1,366.15223,[M+H]+,20.0,val,COc1ccccc1C1(C(=O)NC(C)Cc2csc3ccccc23)CC1
490179,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,348.16052,[M-H]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490180,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,348.16052,[M-H]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490181,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,348.16052,[M-H]-,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490182,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,348.16052,[M-H]-,30.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490183,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,348.16052,[M-H]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490184,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490185,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490186,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490187,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,15.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490188,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490189,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,15.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490190,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490191,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,394.166,[M+FA]-,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490192,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490193,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490194,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490195,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490196,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490197,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,30.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490198,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,60.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490199,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1,350.17507,[M+H]+,20.0,val,Cc1ccc(C)c(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)c1
490200,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C,350.17507,[M+H]+,20.0,val,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C
490201,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C,350.17507,[M+H]+,20.0,val,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C
490202,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C,350.17507,[M+H]+,60.0,val,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C
490203,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C,350.17507,[M+H]+,30.0,val,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C
490204,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C,350.17507,[M+H]+,20.0,val,CC12CCC(C(=O)N(c3ccccc3)c3ccccc3)(OC1=O)C2(C)C
490205,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490206,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490207,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,15.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490208,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490209,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,30.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490210,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490211,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490212,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,332.16451,[M+H-H2O]+,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490213,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,350.17507,[M+H]+,30.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490214,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,350.17507,[M+H]+,30.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490215,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,350.17507,[M+H]+,20.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490216,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,350.17507,[M+H]+,60.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490217,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1,350.17507,[M+H]+,30.0,val,CCC(C(=O)NCC(O)c1ccc(-c2ccco2)cc1)c1ccccc1
490218,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,20.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490219,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,20.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490220,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,60.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490221,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,30.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490222,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,20.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490223,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,60.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490224,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,30.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490225,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1,350.17507,[M+H]+,20.0,val,CN(C)CCOC(=O)c1ccc(COc2cccc3ccccc23)cc1
490226,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,433.10912,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490227,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,433.10912,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490228,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,433.10912,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490229,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,433.10912,[M-H]-,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490230,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,433.10912,[M-H]-,60.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490231,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,479.1146,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490232,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,479.1146,[M+FA]-,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490233,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,479.1146,[M+FA]-,60.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490234,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,435.12367,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490235,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,435.12367,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490236,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,435.12367,[M+H]+,60.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490237,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,435.12367,[M+H]+,30.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490238,O=C(Nc1cc(Cl)c(Cl)cc1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1,435.12367,[M+H]+,20.0,val,O=C(Nc1ccc(Cl)c(Cl)c1)C1CCC(N2C(=O)C3C4CCC(C4)C3C2=O)CC1
490239,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490240,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490241,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490242,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490243,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490244,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490245,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490246,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490247,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,15.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490248,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490249,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490250,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490251,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490252,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490253,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490254,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490255,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490256,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,15.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490257,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490258,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490259,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490260,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490261,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490262,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490263,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490264,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490265,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490266,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490267,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490268,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490269,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490270,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490271,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490272,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490273,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490274,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,15.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490275,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490276,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490277,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,15.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490278,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490279,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490280,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490281,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490282,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490283,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490284,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490285,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490286,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,445.14482,[M-H]-,45.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490287,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490288,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490289,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490290,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,481.1215,[M+Cl]-,15.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490291,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490292,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490293,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490294,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490295,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490296,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490297,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,60.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490298,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490299,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490300,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490301,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,20.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490302,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490303,COc1c(OCCCN2CCOCC2)cc2c(Nc3cc(Cl)c(F)cc3)ncnc2c1,447.15937,[M+H]+,30.0,val,COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
490304,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490305,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490306,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,60.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490307,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,30.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490308,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490309,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,30.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490310,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490311,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,444.13317,[M-H]-,60.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490312,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,480.10985,[M+Cl]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490313,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,480.10985,[M+Cl]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490314,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,480.10985,[M+Cl]-,30.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490315,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,480.10985,[M+Cl]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490316,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490317,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490318,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,60.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490319,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,15.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490320,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490321,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490322,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,60.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490323,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,490.13865,[M+FA]-,15.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490324,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,446.14772,[M+H]+,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490325,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,446.14772,[M+H]+,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490326,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,446.14772,[M+H]+,60.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490327,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,446.14772,[M+H]+,15.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490328,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC,446.14772,[M+H]+,20.0,val,COc1cc(C(=O)N2CCC3(CC2)NC(=O)c2ccc(Cl)cc2N3)cc(OC)c1OC
490329,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490330,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490331,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,60.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490332,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490333,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,45.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490334,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490335,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490336,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,60.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490337,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490338,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,436.16581,[M-H]-,45.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490339,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,437.17254,[M]+,30.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490340,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,437.17254,[M]+,30.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490341,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,437.17254,[M]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490342,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,437.17254,[M]+,60.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490343,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,437.17254,[M]+,30.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490344,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490345,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490346,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,60.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490347,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,30.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490348,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490349,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490350,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490351,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,60.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490352,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,30.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490353,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl,438.18036,[M+H]+,20.0,val,CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1Cl
490354,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,20.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490355,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,20.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490356,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,60.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490357,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,20.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490358,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,60.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490359,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1,429.14787,[M+H]+,20.0,val,COCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1nc(-c2ccccc2)cs1
490360,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,427.13332,[M-H]-,45.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490361,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,427.13332,[M-H]-,45.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490362,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,427.13332,[M-H]-,60.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490363,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,427.13332,[M-H]-,45.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490364,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,429.14787,[M+H]+,20.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490365,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,429.14787,[M+H]+,20.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490366,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,429.14787,[M+H]+,60.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490367,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,429.14787,[M+H]+,30.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490368,CCOC(=O)c1c(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2)scc1CC(C)C,429.14787,[M+H]+,20.0,val,CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc(N2C(=O)CCC2=O)c1
490369,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490370,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490371,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,60.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490372,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,15.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490373,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490374,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,60.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490375,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,15.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490376,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,429.14787,[M+H]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490377,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,446.17442,[M+NH4]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490378,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,446.17442,[M+NH4]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490379,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,446.17442,[M+NH4]+,60.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490380,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,446.17442,[M+NH4]+,30.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490381,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O,446.17442,[M+NH4]+,20.0,val,CCN1C(C(=O)N2CCOCC2)=C(OCc2ccccc2)c2ccccc2S1(=O)=O
490382,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,20.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490383,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,20.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490384,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,60.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490385,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,15.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490386,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,20.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490387,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,20.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490388,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,60.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490389,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1,429.14787,[M+H]+,15.0,val,COc1ccc(OC)c(S(=O)(=O)NCC(c2ccco2)N2CCc3ccccc32)c1
490390,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12,361.20229,[M+H]+,20.0,val,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12
490391,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12,361.20229,[M+H]+,20.0,val,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12
490392,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12,361.20229,[M+H]+,60.0,val,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12
490393,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12,361.20229,[M+H]+,30.0,val,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12
490394,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12,361.20229,[M+H]+,20.0,val,Cc1cccn2cc(-c3ccc(NC(=O)C4CC45CCNCC5)cc3)nc12
490395,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490396,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490397,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,60.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490398,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,30.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490399,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490400,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,60.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490401,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,30.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490402,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490403,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490404,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490405,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,60.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490406,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,30.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490407,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490408,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,60.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490409,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,30.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490410,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1,361.20229,[M+H]+,20.0,val,CN(c1ccccc1)C1CCN(C(=O)c2ccnn2-c2ccccc2)CC1
490411,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,20.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490412,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,20.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490413,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,60.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490414,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,15.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490415,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,20.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490416,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,60.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490417,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,15.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490418,Cc1ccccc1C1(C(=O)Nc2nn(CCc3ccncc3)cc2)CCC1,361.20229,[M+H]+,20.0,val,Cc1ccccc1C1(C(=O)Nc2ccn(CCc3ccncc3)n2)CCC1
490419,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,20.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490420,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,20.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490421,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,60.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490422,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,20.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490423,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,45.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490424,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,60.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490425,Cc1c(C(=O)NC(C)c2cc3c(cc2)CCCC3)cnn1-c1ccncc1,361.20229,[M+H]+,20.0,val,Cc1c(C(=O)NC(C)c2ccc3c(c2)CCCC3)cnn1-c1ccncc1
490426,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,395.16441,[M+Cl]-,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490427,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,395.16441,[M+Cl]-,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490428,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,395.16441,[M+Cl]-,15.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490429,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,395.16441,[M+Cl]-,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490430,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,359.18774,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490431,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,359.18774,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490432,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,359.18774,[M-H]-,60.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490433,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,359.18774,[M-H]-,30.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490434,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,359.18774,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490435,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490436,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490437,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,30.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490438,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490439,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490440,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,45.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490441,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490442,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1,361.20229,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)Cc1cn(C)c2ccccc12)c1nc2ccccc2[nH]1
490443,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,361.20229,[M+H]+,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490444,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,361.20229,[M+H]+,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490445,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,361.20229,[M+H]+,60.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490446,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,361.20229,[M+H]+,30.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490447,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1,361.20229,[M+H]+,20.0,val,O=C(NCCc1cnc[nH]1)C1CN(C(c2ccccc2)c2ccccc2)C1
490448,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,20.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490449,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,20.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490450,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,45.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490451,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,60.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490452,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,20.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490453,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,60.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490454,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,45.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490455,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1,361.20229,[M+H]+,20.0,val,Cc1cc(C)c2nc(C)cc(C(=O)N3CCN(c4ccccn4)CC3)c2c1
490456,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490457,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490458,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,30.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490459,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,60.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490460,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490461,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,45.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490462,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,60.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490463,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,407.17248,[M-H]-,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490464,CN(C)CCOc1c(NC(=O)C2COc3ccccc3O2)ccc(-c2c[nH]nc2)c1,409.18703,[M+H]+,20.0,val,CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)C1COc2ccccc2O1
490465,CN(C)CCOc1c(NC(=O)C2COc3ccccc3O2)ccc(-c2c[nH]nc2)c1,409.18703,[M+H]+,20.0,val,CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)C1COc2ccccc2O1
490466,CN(C)CCOc1c(NC(=O)C2COc3ccccc3O2)ccc(-c2c[nH]nc2)c1,409.18703,[M+H]+,60.0,val,CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)C1COc2ccccc2O1
490467,CN(C)CCOc1c(NC(=O)C2COc3ccccc3O2)ccc(-c2c[nH]nc2)c1,409.18703,[M+H]+,30.0,val,CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)C1COc2ccccc2O1
490468,CN(C)CCOc1c(NC(=O)C2COc3ccccc3O2)ccc(-c2c[nH]nc2)c1,409.18703,[M+H]+,20.0,val,CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)C1COc2ccccc2O1
490469,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490470,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490471,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,60.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490472,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,15.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490473,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490474,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,60.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490475,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,15.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490476,Cc1cn2c(=O)cc(N3CCOCC3)nc2c([C@@H](C)Nc2ccccc2C(=O)O)c1,409.18703,[M+H]+,20.0,val,Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
490477,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,20.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490478,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,20.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490479,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,60.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490480,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,20.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490481,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,45.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490482,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,60.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490483,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,20.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490484,COc1cc(-c2nc(N3CCOCC3)nc(-c3ccncc3)c2)cc(OC)c1OC,409.18703,[M+H]+,45.0,val,COc1cc(-c2cc(-c3ccncc3)nc(N3CCOCC3)n2)cc(OC)c1OC
490485,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490486,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490487,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490488,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490489,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490490,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490491,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,30.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490492,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,407.17248,[M-H]-,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490493,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490494,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490495,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490496,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,15.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490497,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490498,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,60.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490499,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,15.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490500,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O,409.18703,[M+H]+,20.0,val,NC(=O)NCCC[C@@H](NC(=O)Cn1c(-c2ccccc2)cc2ccccc21)C(=O)O
490501,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,453.17796,[M+FA]-,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490502,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,453.17796,[M+FA]-,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490503,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,453.17796,[M+FA]-,60.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490504,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,453.17796,[M+FA]-,30.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490505,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,453.17796,[M+FA]-,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490506,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,443.14916,[M+Cl]-,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490507,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,453.17796,[M+FA]-,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490508,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,453.17796,[M+FA]-,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490509,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,453.17796,[M+FA]-,60.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490510,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,453.17796,[M+FA]-,15.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490511,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,453.17796,[M+FA]-,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490512,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490513,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490514,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,60.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490515,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,15.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490516,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490517,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,20.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490518,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,15.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490519,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1,409.18703,[M+H]+,60.0,val,COc1ccc(-c2noc(C3CCCN3C(=O)NCc3cccc(OC)c3)n2)cc1
490520,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490521,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490522,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,60.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490523,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,15.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490524,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490525,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,60.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490526,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,20.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490527,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1,409.18703,[M+H]+,15.0,val,COc1nn(C)cc1C(=O)NCC(=O)NCc1ccc(OCc2ccccc2)cc1
490528,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,431.12016,[M-H]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490529,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,431.12016,[M-H]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490530,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,431.12016,[M-H]-,45.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490531,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,431.12016,[M-H]-,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490532,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,431.12016,[M-H]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490533,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,467.09684,[M+Cl]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490534,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,467.09684,[M+Cl]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490535,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,467.09684,[M+Cl]-,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490536,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490537,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490538,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490539,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,15.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490540,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490541,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,15.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490542,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490543,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,477.12564,[M+FA]-,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490544,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490545,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490546,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,45.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490547,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490548,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490549,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,20.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490550,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,45.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490551,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1,433.13472,[M+H]+,60.0,val,CS(=O)(=O)N(Cc1ccccc1Cl)c1ccc(C(=O)NC2CC3CCC2C3)cc1
490552,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490553,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490554,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,15.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490555,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490556,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490557,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490558,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490559,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490560,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,45.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490561,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490562,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490563,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,45.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490564,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,440.14457,[M+Cl]-,15.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490565,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,440.14457,[M+Cl]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490566,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,440.14457,[M+Cl]-,15.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490567,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490568,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490569,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490570,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,15.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490571,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490572,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490573,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,15.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490574,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,450.17337,[M+FA]-,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490575,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490576,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490577,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490578,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490579,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,45.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490580,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,60.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490581,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,20.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490582,O[C@@H](CNC[C@H](O)[C@H]1CCc2c(ccc(F)c2)O1)[C@@H]1CCc2c(ccc(F)c2)O1,406.18244,[M+H]+,45.0,val,O[C@@H](CNC[C@H](O)[C@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1
490583,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,442.11356,[M-H]-,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490584,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,442.11356,[M-H]-,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490585,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,442.11356,[M-H]-,60.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490586,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,442.11356,[M-H]-,30.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490587,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,442.11356,[M-H]-,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490588,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490589,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490590,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,60.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490591,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,30.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490592,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490593,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490594,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490595,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,60.0,val,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490596,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,30.0,val,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490597,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490598,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490599,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490600,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,60.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490601,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,30.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490602,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490603,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,30.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490604,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,20.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490605,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21,444.12811,[M+H]+,60.0,val,CC[C@@H](C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21
490606,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,446.13106,[M-H]-,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490607,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,446.13106,[M-H]-,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490608,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,446.13106,[M-H]-,60.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490609,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,446.13106,[M-H]-,30.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490610,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,446.13106,[M-H]-,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490611,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,448.14562,[M+H]+,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490612,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,448.14562,[M+H]+,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490613,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,448.14562,[M+H]+,60.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490614,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,448.14562,[M+H]+,30.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490615,Cc1c(N(CC(=O)NN=C2CCCCCC2)S(=O)(=O)c2ccccc2)ccc(Cl)c1,448.14562,[M+H]+,20.0,val,Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCCC1)S(=O)(=O)c1ccccc1
490616,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,20.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490617,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,20.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490618,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,45.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490619,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,60.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490620,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,20.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490621,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,45.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490622,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,60.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490623,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1,422.20499,[M+H]+,20.0,val,CC(C)(C)c1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1
490624,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,20.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490625,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,20.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490626,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,30.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490627,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,60.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490628,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,15.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490629,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,20.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490630,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,60.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490631,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12,335.21179,[M+H]+,20.0,val,Cc1c(C)n(CC(O)CN2CCc3ccccc3C2)c2ccccc12
490632,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,20.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490633,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,20.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490634,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,60.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490635,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,15.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490636,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,20.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490637,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,60.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490638,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,20.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490639,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12,335.21179,[M+H]+,15.0,val,CN(C)CCNCc1c(OCc2ccccc2)ccc2ccccc12
490640,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490641,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490642,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,60.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490643,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,30.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490644,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490645,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,60.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490646,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,30.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490647,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490648,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490649,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490650,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,60.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490651,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,30.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490652,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490653,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,60.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490654,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,30.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490655,CN1CCC[C@@H]1Cc1c[nH]c2c1cc(CCS(=O)(=O)c1ccccc1)cc2,383.17877,[M+H]+,20.0,val,CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
490656,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490657,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490658,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,60.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490659,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,30.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490660,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490661,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,60.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490662,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,30.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490663,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,429.16672,[M-H]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490664,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,465.1434,[M+Cl]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490665,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,465.1434,[M+Cl]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490666,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,465.1434,[M+Cl]-,60.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490667,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,465.1434,[M+Cl]-,15.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490668,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,465.1434,[M+Cl]-,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490669,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,413.17072,[M+H-H2O]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490670,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,413.17072,[M+H-H2O]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490671,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,413.17072,[M+H-H2O]+,30.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490672,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,413.17072,[M+H-H2O]+,60.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490673,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,413.17072,[M+H-H2O]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490674,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,431.18128,[M+H]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490675,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,431.18128,[M+H]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490676,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,431.18128,[M+H]+,60.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490677,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,431.18128,[M+H]+,15.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490678,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O,431.18128,[M+H]+,20.0,val,O=C(O)CCCCCCCCOc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
490679,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490680,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490681,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,60.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490682,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,30.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490683,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490684,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,60.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490685,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,30.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490686,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,429.16672,[M-H]-,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490687,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490688,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490689,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,60.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490690,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,15.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490691,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490692,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,60.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490693,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,15.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490694,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC,431.18128,[M+H]+,20.0,val,COc1cc(C(=O)NCCC(=O)NC(Cc2ccccc2)C(=O)O)cc(OC)c1OC
490695,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C,435.22515,[M+H]+,30.0,val,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C
490696,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C,435.22515,[M+H]+,30.0,val,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C
490697,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C,435.22515,[M+H]+,20.0,val,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C
490698,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C,435.22515,[M+H]+,60.0,val,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C
490699,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C,435.22515,[M+H]+,30.0,val,Cc1ccc(N2CC(C(=O)N3CCN(c4ncnc5c4nnn5C)CC3)CC2=O)cc1C
490700,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490701,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490702,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,60.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490703,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,15.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490704,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490705,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490706,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,60.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490707,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,15.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490708,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490709,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,60.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490710,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,15.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490711,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,431.17114,[M+FA]-,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490712,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,369.16965,[M+H-H2O]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490713,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,369.16965,[M+H-H2O]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490714,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,369.16965,[M+H-H2O]+,60.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490715,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,369.16965,[M+H-H2O]+,30.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490716,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,369.16965,[M+H-H2O]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490717,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490718,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490719,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,60.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490720,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,15.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490721,CCc1ccc(Cc2cc3c(cc2)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,387.18021,[M+H]+,20.0,val,CCc1ccc(Cc2ccc3c(c2)[C@]2(OC3)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
490722,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,20.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490723,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,20.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490724,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,60.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490725,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,20.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490726,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,45.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490727,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,60.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490728,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,20.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490729,COc1cc(OC)c2C(=O)CC(c3ccccc3)Oc2c1CC(O)C(C)(C)O,387.18021,[M+H]+,45.0,val,COc1cc(OC)c2c(c1CC(O)C(C)(C)O)OC(c1ccccc1)CC2=O
490730,COc1c(OC(C)Cc2cc(OC)c(OC)c(OC)c2)ccc(/C=C/C=O)c1,387.18021,[M+H]+,20.0,val,COc1cc(/C=C/C=O)ccc1OC(C)Cc1cc(OC)c(OC)c(OC)c1
490731,COc1c(OC(C)Cc2cc(OC)c(OC)c(OC)c2)ccc(/C=C/C=O)c1,387.18021,[M+H]+,20.0,val,COc1cc(/C=C/C=O)ccc1OC(C)Cc1cc(OC)c(OC)c(OC)c1
490732,COc1c(OC(C)Cc2cc(OC)c(OC)c(OC)c2)ccc(/C=C/C=O)c1,387.18021,[M+H]+,60.0,val,COc1cc(/C=C/C=O)ccc1OC(C)Cc1cc(OC)c(OC)c(OC)c1
490733,COc1c(OC(C)Cc2cc(OC)c(OC)c(OC)c2)ccc(/C=C/C=O)c1,387.18021,[M+H]+,15.0,val,COc1cc(/C=C/C=O)ccc1OC(C)Cc1cc(OC)c(OC)c(OC)c1
490734,COc1c(OC(C)Cc2cc(OC)c(OC)c(OC)c2)ccc(/C=C/C=O)c1,387.18021,[M+H]+,20.0,val,COc1cc(/C=C/C=O)ccc1OC(C)Cc1cc(OC)c(OC)c(OC)c1
490735,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,493.08021,[M-H]-,45.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490736,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,493.08021,[M-H]-,45.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490737,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,493.08021,[M-H]-,45.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490738,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,493.08021,[M-H]-,20.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490739,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,493.08021,[M-H]-,60.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490740,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,529.05689,[M+Cl]-,20.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490741,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,529.05689,[M+Cl]-,20.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490742,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,529.05689,[M+Cl]-,60.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490743,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br,529.05689,[M+Cl]-,20.0,val,Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)C)cc1Br
490744,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,533.10674,[M-H]-,20.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490745,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,533.10674,[M-H]-,20.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490746,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,533.10674,[M-H]-,60.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490747,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,533.10674,[M-H]-,20.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490748,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,533.10674,[M-H]-,45.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490749,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,579.11222,[M+FA]-,20.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490750,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,579.11222,[M+FA]-,20.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490751,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1cc(O)c(O)cc1,579.11222,[M+FA]-,60.0,val,O=C(O[C@H]1[C@@H]2C[C@@H]3OC[C@](O)([C@@H]1Cl)[C@H]2C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O3)c1ccc(O)c(O)c1
490752,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,473.11393,[M+Cl]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490753,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,473.11393,[M+Cl]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490754,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490755,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490756,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,60.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490757,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,15.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490758,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490759,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,60.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490760,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,15.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490761,CCOc1ccc(Cc2c(Cl)ccc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490762,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490763,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490764,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,60.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490765,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,15.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490766,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490767,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,60.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490768,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,15.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490769,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1,439.15181,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2(O)C(OC)O1
490770,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490771,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490772,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,60.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490773,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,15.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490774,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490775,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,20.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490776,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,15.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490777,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1,483.14273,[M+FA]-,60.0,val,CCOc1ccc(Cc2cc(C3(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1
490778,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490779,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490780,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,60.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490781,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490782,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,60.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490783,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,420.21535,[M-H]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490784,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,456.19202,[M+Cl]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490785,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,456.19202,[M+Cl]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490786,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,456.19202,[M+Cl]-,60.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490787,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,456.19202,[M+Cl]-,15.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490788,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,456.19202,[M+Cl]-,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490789,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490790,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490791,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,60.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490792,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490793,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,45.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490794,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,60.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490795,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,20.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490796,Cc1nc2c(C(=O)NC3CCCN(c4ncnc(N5CCOCC5)c4)C3)cccc2[nH]1,422.2299,[M+H]+,45.0,val,Cc1nc2c(C(=O)NC3CCCN(c4cc(N5CCOCC5)ncn4)C3)cccc2[nH]1
490797,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490798,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490799,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,45.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490800,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,60.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490801,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490802,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,60.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490803,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,45.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490804,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,431.14686,[M-H]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490805,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,477.15234,[M+FA]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490806,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,477.15234,[M+FA]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490807,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,477.15234,[M+FA]-,60.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490808,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,477.15234,[M+FA]-,30.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490809,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,477.15234,[M+FA]-,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490810,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490811,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490812,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,60.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490813,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,30.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490814,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490815,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,30.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490816,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,60.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490817,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1,433.16141,[M+H]+,20.0,val,CCc1ccc(C(C)NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CCC2)C3)cc1
490818,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490819,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490820,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490821,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490822,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490823,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490824,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490825,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490826,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490827,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490828,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490829,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490830,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490831,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490832,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490833,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490834,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490835,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490836,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490837,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490838,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490839,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490840,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490841,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490842,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490843,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490844,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490845,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490846,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,60.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490847,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,20.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490848,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC,385.21218,[M+H]+,45.0,val,CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
490849,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,20.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490850,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,20.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490851,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,60.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490852,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,30.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490853,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,20.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490854,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,60.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490855,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,30.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490856,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1,385.21218,[M+H]+,20.0,val,CCOc1cc(NC(=O)C(C)(C)C)c(OCC)cc1NC(=O)c1ccccc1
490857,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,20.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490858,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,20.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490859,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,30.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490860,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,60.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490861,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,20.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490862,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,45.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490863,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,60.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490864,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC,385.21218,[M+H]+,20.0,val,COc1cccc(C(=O)NCCCN2CCOC(c3ccccc3)C2)c1OC
490865,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO,401.19696,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
490866,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO,401.19696,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
490867,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO,401.19696,[M+FA]-,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
490868,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO,401.19696,[M+FA]-,15.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
490869,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO,401.19696,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
490870,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490871,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490872,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,60.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490873,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,15.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490874,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490875,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,60.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490876,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,15.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490877,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,357.20603,[M+H]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490878,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,374.23258,[M+NH4]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490879,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,374.23258,[M+NH4]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490880,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,374.23258,[M+NH4]+,60.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490881,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,374.23258,[M+NH4]+,30.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490882,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC,374.23258,[M+NH4]+,20.0,val,COc1cc(CCc2ccc(OCC=C(C)C)cc2)cc(OC)c1OC
490883,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,465.17662,[M+FA]-,20.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490884,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,465.17662,[M+FA]-,60.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490885,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,465.17662,[M+FA]-,15.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490886,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,465.17662,[M+FA]-,20.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490887,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,465.17662,[M+FA]-,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490888,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,465.17662,[M+FA]-,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490889,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,465.17662,[M+FA]-,60.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490890,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,465.17662,[M+FA]-,15.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490891,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,465.17662,[M+FA]-,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490892,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,438.21224,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490893,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,438.21224,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490894,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,438.21224,[M+NH4]+,60.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490895,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,438.21224,[M+NH4]+,15.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490896,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1,438.21224,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12[C@H](O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1C[C@H](O)C[C@]21CO1
490897,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490898,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490899,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,60.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490900,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,30.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490901,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490902,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,60.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490903,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,30.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490904,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,403.17513,[M+H-H2O]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
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490906,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,438.21224,[M+NH4]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490907,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,438.21224,[M+NH4]+,60.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
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490909,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12,438.21224,[M+NH4]+,20.0,val,C=C1C(=O)O[C@@H]2C=C(C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@H]12
490910,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490911,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490912,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490913,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490914,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490915,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,30.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490916,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490917,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490918,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490919,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490920,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,15.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490921,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490922,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490923,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,15.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490924,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490925,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490926,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490927,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490928,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,15.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490929,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490930,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490931,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490932,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
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490937,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490938,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,30.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490939,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490940,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490941,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,30.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490942,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490943,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490944,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490945,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490946,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,30.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490947,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490948,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490949,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,30.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490950,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490951,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490952,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490953,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,30.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490954,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,427.1693,[M+Cl]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490955,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490956,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490957,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490958,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,30.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490959,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490960,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490961,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,30.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490962,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,437.1981,[M+FA]-,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490963,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490964,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490965,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,60.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490966,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,15.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490967,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490968,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490969,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490970,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,15.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490971,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490972,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,30.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490973,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490974,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490975,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,393.20718,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
490976,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490977,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490978,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,60.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490979,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,30.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490980,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490981,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,60.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490982,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,30.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490983,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490984,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490985,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490986,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,60.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490987,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,30.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490988,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490989,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,60.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490990,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,30.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490991,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1,432.19515,[M+H]+,20.0,val,O=C(C[S+]([O-])Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
490992,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490993,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490994,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,30.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490995,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,60.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490996,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,15.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490997,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490998,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,60.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
490999,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,476.18608,[M+FA]-,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491000,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491001,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491002,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,60.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491003,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,15.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491004,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491005,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,60.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491006,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,20.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491007,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1,432.19515,[M+H]+,15.0,val,COC1(CNC(=O)NC(c2ccccc2)c2ccccc2)CCN(S(C)(=O)=O)CC1
491008,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491009,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491010,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,60.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491011,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491012,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,45.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491013,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,60.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491014,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,474.18166,[M-H]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491015,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,510.15834,[M+Cl]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491016,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,510.15834,[M+Cl]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491017,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,510.15834,[M+Cl]-,60.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491018,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,510.15834,[M+Cl]-,15.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491019,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,510.15834,[M+Cl]-,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491020,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,476.19622,[M+H]+,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491021,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,476.19622,[M+H]+,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491022,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,476.19622,[M+H]+,60.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491023,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,476.19622,[M+H]+,15.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491024,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2c(O)c(C(=O)N(C)C)c(C)cc2)C(C)(C)C)o1,476.19622,[M+H]+,20.0,val,Cc1ccc([C@H](N=C2NS(=O)(=O)N=C2Nc2ccc(C)c(C(=O)N(C)C)c2O)C(C)(C)C)o1
491025,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491026,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491027,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491028,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491029,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491030,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491031,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491032,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
491033,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491034,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491035,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491036,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491037,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491038,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491039,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491040,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491041,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,20.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491042,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,20.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491043,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,60.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491044,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,15.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491045,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,20.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491046,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,60.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491047,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,15.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491048,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC,340.2271,[M+H]+,20.0,val,CCOc1ccc(CNCC2(c3ccccc3)CCCC2)cc1OC
491049,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,20.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491050,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,20.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491051,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,45.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491052,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,60.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491053,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,20.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491054,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,60.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491055,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,45.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491056,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1,340.2271,[M+H]+,20.0,val,CC1CC(C)CN(CC(O)COc2ccc(-c3ccccc3)cc2)C1
491057,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491058,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491059,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491060,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491061,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491062,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491063,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491064,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,C[C@H](CN1CCC(Cc2ccccc2)CC1)[C@H](O)c1ccc(O)cc1
491065,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491066,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491067,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,30.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491068,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491069,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,15.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491070,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491071,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,20.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491072,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1,340.2271,[M+H]+,60.0,val,CC(CN1CCC(Cc2ccccc2)CC1)C(O)c1ccc(O)cc1
491073,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,20.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491074,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,20.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491075,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,45.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491076,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,60.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491077,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,20.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491078,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,45.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491079,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,60.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491080,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1,340.2271,[M+H]+,20.0,val,CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
491081,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,20.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491082,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,20.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491083,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,60.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491084,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,20.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491085,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,45.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491086,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,60.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491087,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,20.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
491088,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1,438.24752,[M+H]+,45.0,val,CC(C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2nccn2C(C)C)CC1
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491130,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O,473.17351,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O
491131,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O,473.17351,[M+H]+,60.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O
491132,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O,473.17351,[M+H]+,15.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O
491133,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O,473.17351,[M+H]+,20.0,val,C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O
491134,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,409.23575,[M-H]-,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491135,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,409.23575,[M-H]-,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491136,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,409.23575,[M-H]-,60.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491137,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,409.23575,[M-H]-,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491138,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,409.23575,[M-H]-,45.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491139,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,411.2503,[M+H]+,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491140,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,411.2503,[M+H]+,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491141,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,411.2503,[M+H]+,60.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491142,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,411.2503,[M+H]+,20.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491143,CCCCOc1nc(N)c2NC(=O)CN(Cc3cccc(CN4CCCC4)c3)c2n1,411.2503,[M+H]+,45.0,val,CCCCOc1nc(N)c2c(n1)N(Cc1cccc(CN3CCCC3)c1)CC(=O)N2
491144,CN(C)c1cc2c(cc1Sc1nc3c(ccnc3N)n1CCNCC(C)(C)C)OCO2,443.22237,[M+H]+,20.0,val,CN(C)c1cc2c(cc1Sc1nc3c(N)nccc3n1CCNCC(C)(C)C)OCO2
491145,CN(C)c1cc2c(cc1Sc1nc3c(ccnc3N)n1CCNCC(C)(C)C)OCO2,443.22237,[M+H]+,20.0,val,CN(C)c1cc2c(cc1Sc1nc3c(N)nccc3n1CCNCC(C)(C)C)OCO2
491146,CN(C)c1cc2c(cc1Sc1nc3c(ccnc3N)n1CCNCC(C)(C)C)OCO2,443.22237,[M+H]+,60.0,val,CN(C)c1cc2c(cc1Sc1nc3c(N)nccc3n1CCNCC(C)(C)C)OCO2
491147,CN(C)c1cc2c(cc1Sc1nc3c(ccnc3N)n1CCNCC(C)(C)C)OCO2,443.22237,[M+H]+,20.0,val,CN(C)c1cc2c(cc1Sc1nc3c(N)nccc3n1CCNCC(C)(C)C)OCO2
491148,CN(C)c1cc2c(cc1Sc1nc3c(ccnc3N)n1CCNCC(C)(C)C)OCO2,443.22237,[M+H]+,45.0,val,CN(C)c1cc2c(cc1Sc1nc3c(N)nccc3n1CCNCC(C)(C)C)OCO2
491149,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,487.2133,[M+FA]-,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491150,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,487.2133,[M+FA]-,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491151,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,487.2133,[M+FA]-,60.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491152,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,487.2133,[M+FA]-,15.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491153,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,487.2133,[M+FA]-,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491154,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491155,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491156,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,60.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491157,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491158,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,45.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491159,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,60.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491160,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,20.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491161,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4c(C)ccc(C)c4)CC3)CC2)n1,443.22237,[M+H]+,45.0,val,CC(=O)Nc1nsc(N2CCC(C(=O)N3CCN(c4cc(C)ccc4C)CC3)CC2)n1
491162,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,437.2419,[M-H]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491163,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,437.2419,[M-H]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491164,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,437.2419,[M-H]-,60.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491165,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,437.2419,[M-H]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491166,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,437.2419,[M-H]-,60.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491167,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,473.21857,[M+Cl]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491168,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,483.24737,[M+FA]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491169,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,483.24737,[M+FA]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491170,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,483.24737,[M+FA]-,60.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491171,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,483.24737,[M+FA]-,15.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491172,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,483.24737,[M+FA]-,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491173,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491174,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491175,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,45.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491176,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,60.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491177,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491178,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,60.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491179,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,45.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491180,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21,439.25645,[M+H]+,20.0,val,COCCn1cnc2c(N3CC4CN(C(=O)c5cc(C(C)(C)C)[nH]n5)CC4C3)ncnc21
491181,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O,357.18937,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O
491182,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O,357.18937,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O
491183,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O,357.18937,[M-H]-,60.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O
491184,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O,357.18937,[M-H]-,30.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O
491185,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O,357.18937,[M-H]-,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/CSc1ccccc1C(=O)O
491186,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C,435.20244,[M+FA]-,20.0,val,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C
491187,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C,435.20244,[M+FA]-,60.0,val,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C
491188,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C,435.20244,[M+FA]-,15.0,val,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C
491189,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C,435.20244,[M+FA]-,20.0,val,CC(=O)OC12C(O)C(C)C3(O)C4C=C(C)C(=O)C4CC(CO)=CC3C1C2(C)C
491190,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3cocc3)C2C1,389.19696,[M-H]-,20.0,val,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3ccoc3)C2C1
491191,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3cocc3)C2C1,389.19696,[M-H]-,20.0,val,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3ccoc3)C2C1
491192,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3cocc3)C2C1,389.19696,[M-H]-,60.0,val,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3ccoc3)C2C1
491193,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3cocc3)C2C1,389.19696,[M-H]-,15.0,val,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3ccoc3)C2C1
491194,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3cocc3)C2C1,389.19696,[M-H]-,20.0,val,CC(=O)OC1C=C(C(=O)O)C2(CO)CCC(C)C(C)(CCc3ccoc3)C2C1
491195,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,389.19696,[M-H]-,20.0,val,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13
491196,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,389.19696,[M-H]-,20.0,val,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13
491197,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,389.19696,[M-H]-,60.0,val,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13
491198,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,389.19696,[M-H]-,30.0,val,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13
491199,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13,389.19696,[M-H]-,20.0,val,COc1c(C(C)C)c(O)c(O)c2c1C(OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13
491200,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491201,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491202,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,45.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491203,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491204,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491205,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491206,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,45.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491207,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1,450.20572,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)CC1
491208,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1,470.26226,[M+H]+,20.0,val,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1
491209,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1,470.26226,[M+H]+,20.0,val,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1
491210,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1,470.26226,[M+H]+,60.0,val,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1
491211,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1,470.26226,[M+H]+,20.0,val,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1
491212,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1,470.26226,[M+H]+,45.0,val,CCn1nc(C2CCN(C(=O)CCO)CC2)nc1-c1cnc(N)c(-c2nnc(C(C)(C)C)o2)n1
491213,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491214,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491215,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,60.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491216,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491217,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,45.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491218,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,60.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491219,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491220,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,45.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491221,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491222,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491223,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,60.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491224,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491225,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,45.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491226,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,60.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491227,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,20.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491228,CC(C)N(CC[C@H](c1ccccc1)c1c(O)ccc(CO)c1)C(C)C,342.24275,[M+H]+,45.0,val,CC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
491229,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491230,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491231,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,60.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491232,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,30.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491233,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491234,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,60.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491235,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,30.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491236,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491237,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,386.23368,[M+FA]-,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491238,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,386.23368,[M+FA]-,60.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491239,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,386.23368,[M+FA]-,15.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491240,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,386.23368,[M+FA]-,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491241,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491242,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491243,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,60.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491244,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,30.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491245,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491246,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,20.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491247,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,30.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491248,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1,342.24275,[M+H]+,60.0,val,CCCC(NC(CCC)C(O)c1ccccc1)C(O)c1ccccc1
491249,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,20.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491250,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,20.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491251,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,60.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491252,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,20.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491253,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,60.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491254,CCCn1c(=O)c2c(nc(C34CCC(CCC(=O)O)(CC3)CC4)[nH]2)n(CCC)c1=O,415.23508,[M-H]-,20.0,val,CCCn1c(=O)c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc2n(CCC)c1=O
491255,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,20.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491256,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,20.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491257,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,60.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491258,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,20.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491259,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,45.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491260,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,60.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491261,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,20.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491262,CC(C)N1CCC(CC(=O)N2CCc3c(C2)c(-c2nc(C4CC4)no2)nn3C)CC1,413.26595,[M+H]+,45.0,val,CC(C)N1CCC(CC(=O)N2CCc3c(c(-c4nc(C5CC5)no4)nn3C)C2)CC1
491263,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491264,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491265,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,45.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491266,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,60.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491267,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491268,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,45.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491269,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,60.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491270,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1,413.26595,[M+H]+,20.0,val,Cc1cc(C)c2c(N3CCOCC3)nc(C(=O)NCCCN3CCCCC3)nc2n1
491271,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,386.24492,[M-H]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491272,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,386.24492,[M-H]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491273,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,386.24492,[M-H]-,60.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491274,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,386.24492,[M-H]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491275,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,386.24492,[M-H]-,45.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491276,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,422.22159,[M+Cl]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491277,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,422.22159,[M+Cl]-,15.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491278,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491279,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491280,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,60.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491281,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,15.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491282,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491283,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,60.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491284,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,15.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491285,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,432.25039,[M+FA]-,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491286,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,20.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491287,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,20.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491288,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,60.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491289,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,20.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491290,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,45.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491291,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,60.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491292,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,20.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491293,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1,388.25947,[M+H]+,45.0,val,CC1CCN(CC2CCCN(C(=O)CNC(=O)COc3ccccc3)C2)CC1
491294,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491295,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491296,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,60.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491297,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,30.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491298,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491299,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,60.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491300,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,30.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491301,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1,388.25947,[M+H]+,20.0,val,C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)NC1CC(C)(C)NC(C)(C)C1
491302,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,386.24492,[M-H]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491303,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,386.24492,[M-H]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491304,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,386.24492,[M-H]-,60.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491305,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,386.24492,[M-H]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491306,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,386.24492,[M-H]-,45.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491307,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,422.22159,[M+Cl]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491308,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,422.22159,[M+Cl]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491309,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,422.22159,[M+Cl]-,60.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491310,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,422.22159,[M+Cl]-,15.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491311,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,422.22159,[M+Cl]-,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491312,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491313,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491314,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,60.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491315,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,30.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491316,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491317,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,60.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491318,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,30.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491319,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1,388.25947,[M+H]+,20.0,val,CCCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)C(C)(C)C)CC1
491320,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,386.24492,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491321,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,386.24492,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491322,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,386.24492,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491323,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,386.24492,[M-H]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491324,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,386.24492,[M-H]-,60.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491325,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,432.25039,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491326,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,432.25039,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491327,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,432.25039,[M+FA]-,60.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491328,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,432.25039,[M+FA]-,15.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491329,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,432.25039,[M+FA]-,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491330,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,388.25947,[M+H]+,30.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491331,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,388.25947,[M+H]+,30.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491332,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,388.25947,[M+H]+,60.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491333,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,388.25947,[M+H]+,20.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491334,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1,388.25947,[M+H]+,30.0,val,CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)CCC2CCCCC2)cc1
491335,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,373.24967,[M-H]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491336,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,373.24967,[M-H]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491337,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,373.24967,[M-H]-,60.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491338,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,373.24967,[M-H]-,30.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491339,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,373.24967,[M-H]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491340,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,419.25515,[M+FA]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491341,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,419.25515,[M+FA]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491342,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,419.25515,[M+FA]-,60.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491343,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,419.25515,[M+FA]-,15.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491344,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,419.25515,[M+FA]-,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491345,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,357.25366,[M+H-H2O]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491346,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,357.25366,[M+H-H2O]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491347,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,357.25366,[M+H-H2O]+,30.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491348,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,357.25366,[M+H-H2O]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491349,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,357.25366,[M+H-H2O]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491350,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,375.26422,[M+H]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491351,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,375.26422,[M+H]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491352,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,375.26422,[M+H]+,60.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491353,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,375.26422,[M+H]+,15.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491354,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1,375.26422,[M+H]+,20.0,val,CC(C)C1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)CO)CC1
491355,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491356,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491357,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,60.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491358,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,30.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491359,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491360,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,60.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491361,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,30.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491362,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491363,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491364,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491365,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,60.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491366,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,30.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491367,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491368,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,60.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491369,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,30.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491370,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12,371.28054,[M+H]+,20.0,val,NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
491371,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,20.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491372,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,20.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491373,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,45.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491374,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,60.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491375,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,20.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491376,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,45.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491377,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,60.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491378,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1,418.28127,[M+H]+,20.0,val,CC(C)N1CCN(CC#CCOC2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)CC1
491379,CCCCCCCCCCCCCCCc1c(C(=O)O)c(O)ccc1,347.25917,[M-H]-,20.0,val,CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)O
491380,CCCCCCCCCCCCCCCc1c(C(=O)O)c(O)ccc1,347.25917,[M-H]-,20.0,val,CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)O
491381,CCCCCCCCCCCCCCCc1c(C(=O)O)c(O)ccc1,347.25917,[M-H]-,60.0,val,CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)O
491382,CCCCCCCCCCCCCCCc1c(C(=O)O)c(O)ccc1,347.25917,[M-H]-,20.0,val,CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)O
491383,CCCCCCCCCCCCCCCc1c(C(=O)O)c(O)ccc1,347.25917,[M-H]-,45.0,val,CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)O
491384,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491385,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491386,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,60.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491387,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,30.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491388,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491389,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,60.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491390,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,30.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491391,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,349.27372,[M+H]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491392,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,366.30027,[M+NH4]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491393,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,366.30027,[M+NH4]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491394,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,366.30027,[M+NH4]+,60.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491395,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,366.30027,[M+NH4]+,15.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491396,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,366.30027,[M+NH4]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491397,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,371.25566,[M+Na]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491398,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O,371.25566,[M+Na]+,20.0,val,C=C1CCC2C(C)(C)CC(=O)CC2(C)C1CCC(C)CCOC(C)=O
491399,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491400,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491401,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,60.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491402,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,30.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491403,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491404,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491405,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491406,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,60.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491407,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,30.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491408,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,475.25487,[M+FA]-,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491409,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,448.29049,[M+NH4]+,15.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491410,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,448.29049,[M+NH4]+,15.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491411,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,448.29049,[M+NH4]+,20.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491412,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,448.29049,[M+NH4]+,60.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491413,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O,448.29049,[M+NH4]+,15.0,val,COC1OC(OC)C(O)(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C32CO2)C1O
491414,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491415,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491416,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,60.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491417,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491418,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,45.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491419,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,60.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491420,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491421,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491422,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491423,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,60.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491424,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491425,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,45.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491426,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,60.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491427,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,20.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491428,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1,334.31044,[M]+,45.0,val,CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1
491429,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,481.0797,[M-H]-,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491430,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,481.0797,[M-H]-,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491431,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,481.0797,[M-H]-,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491432,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,481.0797,[M-H]-,30.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491433,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,481.0797,[M-H]-,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491434,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491435,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491436,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491437,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491438,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,45.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491439,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491440,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491441,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,45.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491442,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491443,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491444,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491445,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491446,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,45.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491447,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491448,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491449,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491450,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491451,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491452,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491453,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,45.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491454,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,60.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491455,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,20.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491456,[O-][n+]1cccc(-c2c([C@@H](Nc3c4ncccc4ncn3)C(F)(F)F)cc3cccc(Cl)c3n2)c1,483.09425,[M+H]+,45.0,val,[O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
491457,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491458,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491459,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,60.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491460,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,30.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491461,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491462,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,30.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491463,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,60.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491464,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,427.11244,[M-H]-,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491465,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,429.12699,[M+H]+,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491466,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,429.12699,[M+H]+,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491467,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,429.12699,[M+H]+,60.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491468,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,429.12699,[M+H]+,20.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491469,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F,429.12699,[M+H]+,60.0,val,O=C(Nc1cccc(-c2ccc3nnc(-c4ccncc4)n3n2)c1)c1c(F)cccc1F
491470,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491471,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491472,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,60.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491473,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491474,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,45.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491475,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,60.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491476,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491477,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,363.12514,[M-H]-,45.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491478,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,365.13969,[M+H]+,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491479,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,365.13969,[M+H]+,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491480,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,365.13969,[M+H]+,60.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491481,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,365.13969,[M+H]+,20.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491482,N#Cc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)ccc1,365.13969,[M+H]+,45.0,val,N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c1
491483,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1,435.07532,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1
491484,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1,435.07532,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1
491485,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1,435.07532,[M-H]-,45.0,val,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1
491486,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1,435.07532,[M-H]-,60.0,val,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1
491487,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1,435.07532,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)cc2)C3=O)c1
491488,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,435.07532,[M-H]-,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491489,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,435.07532,[M-H]-,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491490,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,435.07532,[M-H]-,30.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491491,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,435.07532,[M-H]-,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491492,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,437.08988,[M+H]+,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491493,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,437.08988,[M+H]+,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491494,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,437.08988,[M+H]+,60.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491495,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,437.08988,[M+H]+,20.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491496,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12,437.08988,[M+H]+,60.0,val,COC(=O)COc1cc(-c2cccc(Cl)c2)nc2ccc(NC(=O)c3ccco3)cc12
491497,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491498,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491499,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,60.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491500,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491501,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,60.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491502,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,443.10287,[M-H]-,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491503,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491504,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491505,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,45.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491506,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,60.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491507,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491508,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,60.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491509,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,45.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491510,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,445.11743,[M+H]+,20.0,val,O=C(c1ccc2nc[nH]c2c1)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491511,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491512,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491513,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491514,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491515,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491516,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,398.11463,[M-H]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491517,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,434.09131,[M+Cl]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491518,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,434.09131,[M+Cl]-,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491519,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,434.09131,[M+Cl]-,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491520,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,434.09131,[M+Cl]-,15.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491521,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491522,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491523,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491524,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491525,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491526,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1,400.12918,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1-c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1
491527,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491528,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491529,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,60.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491530,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491531,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,45.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491532,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,60.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491533,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,430.0867,[M-H]-,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491534,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491535,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491536,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,60.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491537,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491538,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,45.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491539,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,60.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491540,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,20.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491541,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23,432.10125,[M+H]+,45.0,val,CN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(Oc5ccncc5)cc4)ccc1c23
491542,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,385.14701,[M-H]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491543,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,385.14701,[M-H]-,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491544,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,385.14701,[M-H]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491545,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,385.14701,[M-H]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491546,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,421.12369,[M+Cl]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491547,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,421.12369,[M+Cl]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491548,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,421.12369,[M+Cl]-,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491549,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,421.12369,[M+Cl]-,15.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491550,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,421.12369,[M+Cl]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491551,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491552,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491553,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491554,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,15.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491555,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491556,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491557,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,15.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491558,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,431.15249,[M+FA]-,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491559,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491560,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491561,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491562,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491563,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,45.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491564,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,60.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491565,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,20.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491566,O=C(Cc1cnccc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1,387.16156,[M+H]+,45.0,val,O=C(Cc1cccnc1)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1
491567,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O,374.13868,[M+H]+,45.0,val,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O
491568,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O,374.13868,[M+H]+,45.0,val,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O
491569,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O,374.13868,[M+H]+,45.0,val,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O
491570,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O,374.13868,[M+H]+,60.0,val,CCc1ccccc1N1C(=O)c2ccc(Oc3ccccc3OC)cc2C1=O
491571,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,464.06153,[M-H]-,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491572,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,464.06153,[M-H]-,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491573,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,464.06153,[M-H]-,60.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491574,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,464.06153,[M-H]-,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491575,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,464.06153,[M-H]-,45.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491576,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,466.07608,[M+H]+,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491577,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,466.07608,[M+H]+,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491578,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,466.07608,[M+H]+,60.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491579,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,466.07608,[M+H]+,15.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491580,O=C(NCc1ccc(NC(=O)c2cc3c(CCC3)[nH]c2=O)cc1)c1ccc(Br)cc1,466.07608,[M+H]+,20.0,val,O=C(NCc1ccc(NC(=O)c2cc3c([nH]c2=O)CCC3)cc1)c1ccc(Br)cc1
491581,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491582,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491583,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491584,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491585,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491586,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491587,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491588,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491589,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491590,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491591,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491592,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,15.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491593,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491594,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491595,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491596,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491597,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491598,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491599,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491600,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491601,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491602,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491603,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491604,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491605,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491606,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491607,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491608,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491609,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491610,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,15.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491611,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491612,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491613,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491614,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491615,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491616,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491617,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491618,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491619,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,404.11713,[M-H]-,45.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491620,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491621,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491622,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491623,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,15.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491624,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,440.09381,[M+Cl]-,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491625,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491626,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491627,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491628,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491629,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491630,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491631,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491632,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491633,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491634,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491635,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,60.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491636,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,30.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491637,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1,406.13168,[M+H]+,20.0,val,O=C(NCC1(c2ccc(Cl)cc2)CC1)c1ccc(NC(=O)c2ccncc2)cc1
491638,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1,426.11028,[M+H]+,20.0,val,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1
491639,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1,426.11028,[M+H]+,20.0,val,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1
491640,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1,426.11028,[M+H]+,60.0,val,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1
491641,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1,426.11028,[M+H]+,30.0,val,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1
491642,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1,426.11028,[M+H]+,20.0,val,COC(=O)c1ccc(COc2cccc3c2CCN(Cc2ccc(Cl)cc2)C3=O)o1
491643,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491644,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491645,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,45.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491646,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,60.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491647,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491648,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,45.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491649,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,60.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491650,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,415.12342,[M-H]-,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491651,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491652,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491653,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,60.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491654,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,30.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491655,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491656,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,30.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491657,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,60.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491658,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1,417.13797,[M+H]+,20.0,val,O=C(CSc1ccccc1)N1CCc2nc3cc(-c4ccccc4)[nH]n3c(=O)c2C1
491659,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,447.13418,[M-H]-,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491660,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,447.13418,[M-H]-,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491661,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,447.13418,[M-H]-,60.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491662,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,447.13418,[M-H]-,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491663,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,447.13418,[M-H]-,60.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491664,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491665,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491666,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,45.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491667,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,60.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491668,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491669,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,45.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491670,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,60.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491671,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1,449.14873,[M+H]+,20.0,val,O=C(c1n[nH]c2c1CCCC2)N1CCc2c(nc3cc(-c4ccccc4Cl)[nH]n3c2=O)C1
491672,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491673,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491674,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491675,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,30.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491676,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491677,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491678,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,30.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491679,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491680,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,569.11959,[M+Cl]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491681,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,569.11959,[M+Cl]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491682,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,569.11959,[M+Cl]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491683,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,569.11959,[M+Cl]-,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491684,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,569.11959,[M+Cl]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491685,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491686,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491687,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491688,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491689,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491690,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491691,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491692,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491693,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491694,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491695,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491696,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491697,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491698,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491699,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491700,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491701,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,30.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491702,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491703,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491704,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,30.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491705,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,533.14291,[M-H]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491706,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491707,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491708,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491709,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491710,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491711,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491712,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491713,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,579.14839,[M+FA]-,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491714,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491715,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491716,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,15.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491717,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491718,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,30.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491719,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491720,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,60.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491721,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,535.15746,[M+H]+,20.0,val,C[C@@H](O[C@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
491722,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,20.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491723,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,20.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491724,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,60.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491725,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,20.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491726,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,45.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491727,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,60.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491728,c1ccc(-c2c(-c3ccccc3)c3c(NC[C@@H]4CCCO4)ncnc3o2)cc1,372.17065,[M+H]+,20.0,val,c1ccc(-c2oc3ncnc(NC[C@@H]4CCCO4)c3c2-c2ccccc2)cc1
491729,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491730,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491731,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,60.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491732,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,30.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491733,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491734,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,60.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491735,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,30.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491736,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,370.1561,[M-H]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491737,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,406.13278,[M+Cl]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491738,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,406.13278,[M+Cl]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491739,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,406.13278,[M+Cl]-,60.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491740,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,406.13278,[M+Cl]-,15.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491741,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,406.13278,[M+Cl]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491742,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,416.16158,[M+FA]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491743,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,416.16158,[M+FA]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491744,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,416.16158,[M+FA]-,60.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491745,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,416.16158,[M+FA]-,15.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491746,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,416.16158,[M+FA]-,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491747,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,372.17065,[M+H]+,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491748,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,372.17065,[M+H]+,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491749,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,372.17065,[M+H]+,60.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491750,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,372.17065,[M+H]+,15.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491751,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1,372.17065,[M+H]+,20.0,val,CC1(CC(=O)Nc2ccccc2)Nc2ccccc2C(=O)N1c1ccccc1
491752,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,478.11906,[M-H]-,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491753,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,478.11906,[M-H]-,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491754,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,478.11906,[M-H]-,60.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491755,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,478.11906,[M-H]-,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491756,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,478.11906,[M-H]-,45.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491757,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,480.13362,[M+H]+,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491758,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,480.13362,[M+H]+,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491759,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,480.13362,[M+H]+,60.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491760,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,480.13362,[M+H]+,15.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491761,COc1ccccc1Oc1c(NS(=O)(=O)c2ncc(C)cc2)nc(-c2ccncc2)nc1OC,480.13362,[M+H]+,20.0,val,COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OC
491762,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491763,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491764,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,60.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491765,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,30.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491766,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491767,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,60.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491768,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,30.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491769,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC,472.12699,[M+H]+,20.0,val,CCOC(=O)c1nn(-c2ccccc2Cl)c(=O)cc1OCC(=O)Nc1cc(C)ccc1OC
491770,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,438.12932,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491771,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,438.12932,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491772,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,438.12932,[M-H]-,45.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491773,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,438.12932,[M-H]-,60.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491774,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,438.12932,[M-H]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491775,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491776,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491777,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491778,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491779,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491780,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,60.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491781,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491782,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,484.13479,[M+FA]-,15.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491783,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491784,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491785,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,60.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491786,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491787,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,60.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491788,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,438.12932,[M-H]-,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491789,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491790,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491791,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,30.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491792,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,60.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491793,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,15.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491794,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491795,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,60.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491796,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1,440.14387,[M+H]+,20.0,val,O=C(c1cccc(NS(=O)(=O)c2cccc(F)c2)c1)N1CCN(c2ccccc2)CC1
491797,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491798,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491799,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491800,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491801,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491802,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491803,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,30.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491804,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2,440.14387,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCC2
491805,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,434.16339,[M-H]-,20.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491806,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,434.16339,[M-H]-,60.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491807,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,434.16339,[M-H]-,30.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491808,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,434.16339,[M-H]-,20.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491809,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,15.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491810,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,15.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491811,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,20.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491812,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,60.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491813,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,15.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491814,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,60.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491815,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,20.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491816,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12,436.17794,[M+H]+,15.0,val,Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
491817,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,405.1456,[M-H]-,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491818,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,405.1456,[M-H]-,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491819,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,405.1456,[M-H]-,60.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491820,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,405.1456,[M-H]-,30.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491821,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,405.1456,[M-H]-,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491822,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,407.16015,[M+H]+,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491823,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,407.16015,[M+H]+,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491824,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,407.16015,[M+H]+,60.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491825,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,407.16015,[M+H]+,15.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491826,O=C(CC1CCCC1)Nc1c(C(=O)Nc2cc3c(cc2)OCO3)oc2ccccc12,407.16015,[M+H]+,20.0,val,O=C(CC1CCCC1)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12
491827,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491828,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491829,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,60.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491830,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491831,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,45.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491832,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,60.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491833,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491834,Nc1c2c(-c3ccc(Oc4ccccc4)cc3)cn(C3CCCC3)c2ncn1,371.18664,[M+H]+,45.0,val,Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
491835,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1,371.18664,[M+H]+,20.0,val,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1
491836,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1,371.18664,[M+H]+,20.0,val,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1
491837,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1,371.18664,[M+H]+,60.0,val,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1
491838,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1,371.18664,[M+H]+,20.0,val,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1
491839,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1,371.18664,[M+H]+,60.0,val,c1ccc(Nc2c(-c3ccc(N4CCOCC4)cc3)nc3ccccn23)cc1
491840,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491841,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491842,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,60.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491843,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,30.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491844,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491845,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,60.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491846,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,30.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491847,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,417.15683,[M-H]-,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491848,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491849,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491850,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,60.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491851,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,30.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491852,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491853,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,60.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491854,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,30.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491855,O=C(NCc1ccc(C(=O)N2CCc3c(C2)nc[nH]c3=O)cc1)OCc1ccccc1,419.17138,[M+H]+,20.0,val,O=C(NCc1ccc(C(=O)N2CCc3c(nc[nH]c3=O)C2)cc1)OCc1ccccc1
491856,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,417.15683,[M-H]-,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491857,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,417.15683,[M-H]-,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491858,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,417.15683,[M-H]-,60.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491859,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,417.15683,[M-H]-,15.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491860,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,417.15683,[M-H]-,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491861,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,419.17138,[M+H]+,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491862,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,419.17138,[M+H]+,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491863,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,419.17138,[M+H]+,60.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491864,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,419.17138,[M+H]+,15.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491865,COc1cc2c(cc1)c(C)c(CCC(=O)Nc1ccc(Cn3cncn3)cc1)c(=O)o2,419.17138,[M+H]+,20.0,val,COc1ccc2c(C)c(CCC(=O)Nc3ccc(Cn4cncn4)cc3)c(=O)oc2c1
491866,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,417.15683,[M-H]-,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491867,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,417.15683,[M-H]-,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491868,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,417.15683,[M-H]-,60.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491869,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,417.15683,[M-H]-,30.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491870,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,417.15683,[M-H]-,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491871,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,419.17138,[M+H]+,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491872,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,419.17138,[M+H]+,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491873,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,419.17138,[M+H]+,60.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491874,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,419.17138,[M+H]+,30.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491875,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,419.17138,[M+H]+,20.0,val,O=C(CCCn1cnc2ccccc2c1=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
491876,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491877,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491878,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,60.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491879,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,30.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491880,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491881,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,45.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491882,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,60.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491883,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,417.15683,[M-H]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491884,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,463.16231,[M+FA]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491885,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,463.16231,[M+FA]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491886,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,463.16231,[M+FA]-,60.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491887,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,463.16231,[M+FA]-,15.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491888,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,463.16231,[M+FA]-,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491889,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491890,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491891,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,60.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491892,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,30.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491893,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491894,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,30.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491895,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491896,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,417.15683,[M-H]-,60.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491897,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,417.15683,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491898,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,417.15683,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491899,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,417.15683,[M-H]-,45.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491900,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,417.15683,[M-H]-,60.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491901,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,417.15683,[M-H]-,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491902,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,417.15683,[M-H]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491903,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,417.15683,[M-H]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491904,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,417.15683,[M-H]-,45.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491905,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,417.15683,[M-H]-,60.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491906,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,417.15683,[M-H]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491907,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,463.16231,[M+FA]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491908,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,463.16231,[M+FA]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491909,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,463.16231,[M+FA]-,60.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491910,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,463.16231,[M+FA]-,15.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491911,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,463.16231,[M+FA]-,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491912,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,463.16231,[M+FA]-,15.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491913,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,463.16231,[M+FA]-,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491914,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491915,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491916,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,45.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491917,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,60.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491918,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491919,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,45.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491920,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,60.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491921,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1,419.17138,[M+H]+,20.0,val,COc1ccc(OC)c(NC(=O)Cn2c(=O)n(-c3ccc(C)cc3)c3ncccc32)c1
491922,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1,419.17138,[M+H]+,20.0,val,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1
491923,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1,419.17138,[M+H]+,20.0,val,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1
491924,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1,419.17138,[M+H]+,60.0,val,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1
491925,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1,419.17138,[M+H]+,30.0,val,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1
491926,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1,419.17138,[M+H]+,20.0,val,COc1ccc(-c2nnc(-c3cccnc3NCc3cccc(OC)c3OC)o2)cc1
491927,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491928,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491929,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,60.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491930,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,15.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491931,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491932,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,60.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491933,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,20.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491934,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1,419.17138,[M+H]+,15.0,val,CCCc1nnc(-c2cc3ccccc3n2CC(=O)Nc2ccc3c(c2)OCCO3)o1
491935,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21,419.17138,[M+H]+,20.0,val,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21
491936,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21,419.17138,[M+H]+,20.0,val,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21
491937,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21,419.17138,[M+H]+,60.0,val,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21
491938,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21,419.17138,[M+H]+,30.0,val,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21
491939,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21,419.17138,[M+H]+,20.0,val,CC(C)Cn1c(=O)c2cc(C(=O)Nc3ccc4c(c3)OCCO4)nn2c2ccccc21
491940,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491941,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491942,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491943,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,30.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491944,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491945,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,30.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491946,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491947,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1,419.17138,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)Cc3noc4ccccc34)n2)cc1
491948,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,419.17138,[M+H]+,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491949,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,419.17138,[M+H]+,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491950,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,419.17138,[M+H]+,60.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491951,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,419.17138,[M+H]+,30.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491952,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21,419.17138,[M+H]+,20.0,val,CCOc1ccccc1C1C=C(C(=O)O)Nc2c(C(=O)Nc3cccc(C)c3)cnn21
491953,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491954,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491955,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,45.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491956,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,60.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491957,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491958,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,60.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491959,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,45.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491960,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC,419.17138,[M+H]+,20.0,val,COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)nc4n3)cc2)cc(OC)c1OC
491961,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,20.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491962,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,20.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491963,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,45.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491964,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,60.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491965,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,20.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491966,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,45.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491967,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,60.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491968,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1,419.17138,[M+H]+,20.0,val,O=C(COc1ccc2c(c1)OCO2)Nc1ccc(-c2ccc(N3CCCC3)nn2)cc1
491969,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491970,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491971,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491972,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491973,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491974,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491975,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,30.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491976,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,453.11575,[M-H]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491977,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,489.09243,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491978,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,489.09243,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491979,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,489.09243,[M+Cl]-,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491980,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,489.09243,[M+Cl]-,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491981,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,489.09243,[M+Cl]-,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491982,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,453.11575,[M-H]-,30.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491983,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,453.11575,[M-H]-,30.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491984,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,453.11575,[M-H]-,20.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491985,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,453.11575,[M-H]-,60.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491986,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,453.11575,[M-H]-,30.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491987,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,455.1303,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491988,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,455.1303,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491989,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,455.1303,[M+H]+,60.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491990,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,455.1303,[M+H]+,15.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491991,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1,455.1303,[M+H]+,20.0,val,CCCSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)Nc2ccccc2)n1
491992,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,455.1303,[M+H]+,20.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491993,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,455.1303,[M+H]+,20.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491994,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,455.1303,[M+H]+,60.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491995,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,455.1303,[M+H]+,15.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491996,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1,455.1303,[M+H]+,20.0,val,CSc1ncc(Cl)c(C(=O)NC(Cc2ccccc2)C(=O)NCc2ccc(C)cc2)n1
491997,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,388.16667,[M-H]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
491998,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,388.16667,[M-H]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
491999,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,388.16667,[M-H]-,60.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492000,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,388.16667,[M-H]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492001,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,388.16667,[M-H]-,45.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492002,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,424.14334,[M+Cl]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492003,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,424.14334,[M+Cl]-,60.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492004,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492005,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492006,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,60.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492007,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,15.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492008,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492009,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,60.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492010,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,15.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492011,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,434.17214,[M+FA]-,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492012,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,389.17339,[M]+,15.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492013,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,389.17339,[M]+,15.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492014,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,389.17339,[M]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492015,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,389.17339,[M]+,60.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492016,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,389.17339,[M]+,15.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492017,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492018,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492019,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,60.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492020,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,30.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492021,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492022,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,60.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492023,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,30.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492024,CC(=O)Nc1ccc(NC(=O)c2c(CN3c4ccccc4CC3C)occ2)cc1,390.18122,[M+H]+,20.0,val,CC(=O)Nc1ccc(NC(=O)c2ccoc2CN2c3ccccc3CC2C)cc1
492025,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,390.18122,[M+H]+,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492026,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,390.18122,[M+H]+,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492027,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,390.18122,[M+H]+,60.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492028,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,390.18122,[M+H]+,30.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492029,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1,390.18122,[M+H]+,20.0,val,O=C1COCC(CC2CN(C(=O)Cn3ccc4ccccc43)c3ccccc32)N1
492030,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,388.16667,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492031,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,388.16667,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492032,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,388.16667,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492033,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,388.16667,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492034,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,388.16667,[M-H]-,45.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492035,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492036,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492037,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492038,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492039,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492040,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492041,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,30.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492042,Cc1c(NC(=O)c2ccc(O)cc2)cc(NC(=O)c2cc(N(C)C)ccc2)cc1,390.18122,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1NC(=O)c1ccc(O)cc1
492043,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,388.16667,[M-H]-,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492044,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,388.16667,[M-H]-,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492045,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,388.16667,[M-H]-,60.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492046,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,388.16667,[M-H]-,30.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492047,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,388.16667,[M-H]-,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492048,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492049,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492050,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,60.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492051,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492052,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,45.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492053,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,60.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492054,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1,390.18122,[M+H]+,20.0,val,CC1=CCC(C(=O)O)C(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)C1
492055,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,388.16667,[M-H]-,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492056,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,388.16667,[M-H]-,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492057,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,388.16667,[M-H]-,60.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492058,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,388.16667,[M-H]-,30.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492059,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,388.16667,[M-H]-,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492060,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,390.18122,[M+H]+,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492061,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,390.18122,[M+H]+,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492062,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,390.18122,[M+H]+,60.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492063,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,390.18122,[M+H]+,30.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492064,COc1noc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)c1,390.18122,[M+H]+,20.0,val,COc1cc(CCC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)on1
492065,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,20.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492066,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,20.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492067,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,45.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492068,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,60.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492069,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,20.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492070,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,60.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492071,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,45.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492072,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1,390.18122,[M+H]+,20.0,val,CC(=O)c1ccc(NC(=O)COc2cccc3ccc(N4CCCC4)nc23)cc1
492073,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,390.18122,[M+H]+,30.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492074,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,390.18122,[M+H]+,30.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492075,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,390.18122,[M+H]+,20.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492076,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,390.18122,[M+H]+,60.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492077,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,390.18122,[M+H]+,30.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492078,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,412.16316,[M+Na]+,20.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492079,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,412.16316,[M+Na]+,20.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492080,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,412.16316,[M+Na]+,45.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492081,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21,412.16316,[M+Na]+,60.0,val,CCCn1cc(-c2nc(-c3ccccc3OCC)no2)c(=O)c2cc(C)ccc21
492082,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,384.18298,[M-H]-,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492083,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,384.18298,[M-H]-,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492084,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,384.18298,[M-H]-,60.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492085,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,384.18298,[M-H]-,30.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492086,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,384.18298,[M-H]-,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492087,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,20.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492088,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,20.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492089,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,60.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492090,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,15.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492091,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,20.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492092,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,60.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492093,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,15.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492094,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2c3cc[nH]c3ccc2)n1,386.19754,[M+H]+,20.0,val,Cc1cc(C)nc(NC(Cc2ccccc2)C(=O)Nc2cccc3[nH]ccc23)n1
492095,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492096,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492097,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,60.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492098,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,30.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492099,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492100,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,60.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492101,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,30.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492102,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12,386.19754,[M+H]+,20.0,val,O=C(CCNc1ncccn1)NCC(c1ccccc1)c1c[nH]c2ccccc12
492103,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,20.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492104,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,20.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492105,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,45.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492106,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,60.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492107,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,20.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492108,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,45.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492109,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,60.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492110,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1,386.19754,[M+H]+,20.0,val,Cc1ccc2nc(N3CCN(C)CC3)c(-c3noc(-c4ccccc4)n3)cc2c1
492111,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492112,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492113,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,15.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492114,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,60.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492115,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,30.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492116,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492117,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,60.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492118,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,432.14997,[M-H]-,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492119,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,478.15545,[M+FA]-,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492120,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,478.15545,[M+FA]-,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492121,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,478.15545,[M+FA]-,60.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492122,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,478.15545,[M+FA]-,15.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492123,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,478.15545,[M+FA]-,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492124,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492125,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492126,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,60.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492127,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,15.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492128,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492129,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,60.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492130,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,15.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492131,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)C1(c2cccs2)CCCC1,434.16452,[M+H]+,20.0,val,O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)C1(c2cccs2)CCCC1
492132,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,434.16452,[M+H]+,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492133,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,434.16452,[M+H]+,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492134,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,434.16452,[M+H]+,60.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492135,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,434.16452,[M+H]+,30.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492136,Cc1cc2c(cc1)[nH]cc2CCNC(=O)CCc1nnc(C(=O)Nc2ccccc2)s1,434.16452,[M+H]+,20.0,val,Cc1ccc2[nH]cc(CCNC(=O)CCc3nnc(C(=O)Nc4ccccc4)s3)c2c1
492137,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,432.14997,[M-H]-,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492138,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,432.14997,[M-H]-,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492139,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,432.14997,[M-H]-,45.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492140,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,432.14997,[M-H]-,60.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492141,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,432.14997,[M-H]-,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492142,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492143,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492144,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,45.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492145,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,60.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492146,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492147,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,60.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492148,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,45.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492149,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1,434.16452,[M+H]+,20.0,val,Cn1nc(-c2ccccc2)cc1C(=O)N1CCCC(Cc2nc(-c3ccsc3)no2)C1
492150,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,434.16452,[M+H]+,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492151,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,434.16452,[M+H]+,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492152,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,434.16452,[M+H]+,60.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492153,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,434.16452,[M+H]+,30.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492154,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1,434.16452,[M+H]+,20.0,val,CC(C)(C)CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(=O)cc(-c2ccccc2)[nH]1
492155,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21,434.16452,[M+H]+,20.0,val,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21
492156,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21,434.16452,[M+H]+,20.0,val,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21
492157,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21,434.16452,[M+H]+,60.0,val,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21
492158,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21,434.16452,[M+H]+,30.0,val,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21
492159,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21,434.16452,[M+H]+,20.0,val,COc1ccccc1-n1ncc2c(C)nnc(SCC(=O)Nc3cccc(C)c3C)c21
492160,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2,482.13151,[M+H]+,30.0,val,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2
492161,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2,482.13151,[M+H]+,30.0,val,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2
492162,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2,482.13151,[M+H]+,20.0,val,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2
492163,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2,482.13151,[M+H]+,60.0,val,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2
492164,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2,482.13151,[M+H]+,30.0,val,CCOC(=O)c1c(NC(=O)CSc2nnc3c4ccccc4n(CC)c3n2)sc2c1CCC2
492165,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,20.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492166,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,20.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492167,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,60.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492168,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,30.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492169,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,20.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492170,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,30.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492171,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,60.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492172,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1,330.18524,[M+H]+,20.0,val,CC(NC(=O)C(C)(c1ccccc1)c1ccccc1)c1ccccc1
492173,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492174,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492175,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,60.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492176,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,30.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492177,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492178,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,60.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492179,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,30.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492180,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1,330.18524,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
492181,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,20.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492182,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,20.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492183,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,60.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492184,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,30.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492185,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,20.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492186,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,60.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492187,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,30.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492188,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1,330.18524,[M+H]+,20.0,val,O=C(CC(c1ccccc1)c1ccccc1)NCCc1ccccc1
492189,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492190,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492191,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,45.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492192,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,60.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492193,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492194,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,60.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492195,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,45.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492196,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,444.12194,[M-H]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492197,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,480.09862,[M+Cl]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492198,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,480.09862,[M+Cl]-,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492199,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,480.09862,[M+Cl]-,60.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492200,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,480.09862,[M+Cl]-,15.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492201,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,446.13649,[M+H]+,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492202,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,446.13649,[M+H]+,20.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492203,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O,446.13649,[M+H]+,60.0,val,CCOc1cc(C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)cc(Cl)c1OCC(=O)O
492204,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492205,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492206,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,60.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492207,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,30.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492208,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492209,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,60.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492210,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,30.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492211,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,489.14136,[M-H]-,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492212,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492213,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492214,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,60.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492215,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,15.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492216,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492217,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,45.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492218,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,60.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492219,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4c(F)ccc(F)c4)ccc3n2)CC1,491.15591,[M+H]+,20.0,val,CCCN1CCN(c2cc(C(=O)O)c3cc(NS(=O)(=O)c4cc(F)ccc4F)ccc3n2)CC1
492220,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1,426.1646,[M+H]+,60.0,val,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1
492221,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1,426.1646,[M+H]+,60.0,val,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1
492222,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1,426.1646,[M+H]+,20.0,val,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1
492223,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1,426.1646,[M+H]+,60.0,val,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1
492224,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1,426.1646,[M+H]+,60.0,val,O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1
492225,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492226,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492227,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492228,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,15.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492229,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492230,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,424.15005,[M-H]-,15.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492231,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492232,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492233,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492234,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492235,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492236,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,460.12673,[M+Cl]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492237,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492238,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492239,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492240,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,15.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492241,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492242,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492243,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492244,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,470.15553,[M+FA]-,15.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492245,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492246,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492247,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492248,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,30.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492249,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492250,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,30.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492251,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,20.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492252,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2,426.1646,[M+H]+,60.0,val,CCc1c(C#N)c(SCCC(=O)Nc2ccc(F)cc2)nc2c1C(=O)CC(C)(C)C2
492253,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,439.13332,[M-H]-,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492254,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,439.13332,[M-H]-,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492255,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,439.13332,[M-H]-,60.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492256,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,439.13332,[M-H]-,30.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492257,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,439.13332,[M-H]-,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492258,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492259,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492260,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,441.14787,[M+H]+,60.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492261,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492262,COc1c(OC)cc(-c2nc3ccccc3c(C(=O)N[C@@H](CCSC)C(=O)O)c2)cc1,441.14787,[M+H]+,45.0,val,COc1ccc(-c2cc(C(=O)N[C@@H](CCSC)C(=O)O)c3ccccc3n2)cc1OC
492263,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492264,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492265,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,45.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492266,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492267,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,45.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492268,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,439.13332,[M-H]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492269,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,475.10999,[M+Cl]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492270,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,475.10999,[M+Cl]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492271,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,475.10999,[M+Cl]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492272,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,475.10999,[M+Cl]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492273,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,485.1388,[M+FA]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492274,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,485.1388,[M+FA]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492275,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,485.1388,[M+FA]-,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492276,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,485.1388,[M+FA]-,15.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492277,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,485.1388,[M+FA]-,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492278,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492279,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492280,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,60.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492281,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,30.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492282,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492283,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,60.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492284,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,30.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492285,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,405.12675,[M+H-2H2O]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492286,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492287,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492288,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,441.14787,[M+H]+,60.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492289,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,441.14787,[M+H]+,30.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492290,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1,441.14787,[M+H]+,20.0,val,COc1ccc(-c2ccc(S(=O)(=O)N3CC(Oc4cc(C)n(C)c(=O)c4)C3)cc2)cc1
492291,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,441.14787,[M+H]+,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492292,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,441.14787,[M+H]+,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492293,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,441.14787,[M+H]+,60.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492294,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,441.14787,[M+H]+,15.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492295,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1,441.14787,[M+H]+,20.0,val,COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)c1
492296,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,375.15366,[M-H]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492297,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,375.15366,[M-H]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492298,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,375.15366,[M-H]-,60.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492299,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,375.15366,[M-H]-,15.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492300,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,375.15366,[M-H]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492301,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,411.13034,[M+Cl]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492302,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,411.13034,[M+Cl]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492303,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,411.13034,[M+Cl]-,60.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492304,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,411.13034,[M+Cl]-,15.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492305,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,411.13034,[M+Cl]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492306,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,421.15914,[M+FA]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492307,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,421.15914,[M+FA]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492308,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,421.15914,[M+FA]-,60.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492309,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,421.15914,[M+FA]-,15.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492310,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,421.15914,[M+FA]-,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492311,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,377.16821,[M+H]+,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492312,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,377.16821,[M+H]+,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492313,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,377.16821,[M+H]+,60.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492314,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,377.16821,[M+H]+,30.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492315,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1,377.16821,[M+H]+,20.0,val,Cc1ccccc1NC(S)=NCCOc1ccccc1Cc1ccccc1
492316,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492317,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492318,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,60.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492319,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,15.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492320,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492321,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,60.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492322,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,15.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492323,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492324,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492325,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492326,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,60.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492327,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,15.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492328,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492329,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,60.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492330,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,15.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492331,CC(C)Oc1c(C#N)cc(-c2nc(-c3c4CC[C@H](NCCO)c4ccc3)no2)cc1,405.19212,[M+H]+,20.0,val,CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N
492332,CCOc1c(OCC)cc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1,405.19212,[M+H]+,30.0,val,CCOc1ccc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1OCC
492333,CCOc1c(OCC)cc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1,405.19212,[M+H]+,30.0,val,CCOc1ccc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1OCC
492334,CCOc1c(OCC)cc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1,405.19212,[M+H]+,20.0,val,CCOc1ccc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1OCC
492335,CCOc1c(OCC)cc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1,405.19212,[M+H]+,60.0,val,CCOc1ccc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1OCC
492336,CCOc1c(OCC)cc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1,405.19212,[M+H]+,30.0,val,CCOc1ccc(Cc2nc(-c3cccc(-c4ccnn4C)c3)no2)cc1OCC
492337,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,20.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492338,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,20.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492339,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,60.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492340,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,20.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492341,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,60.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492342,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1,405.19212,[M+H]+,20.0,val,CC1CCN(c2ccc(-c3noc(CN4C(=O)COc5ccccc54)n3)cc2)CC1
492343,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,451.16231,[M-H]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492344,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,451.16231,[M-H]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492345,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,451.16231,[M-H]-,60.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492346,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,451.16231,[M-H]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492347,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,451.16231,[M-H]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492348,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,487.13898,[M+Cl]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492349,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,487.13898,[M+Cl]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492350,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,487.13898,[M+Cl]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492351,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,487.13898,[M+Cl]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492352,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492353,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492354,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,60.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492355,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492356,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492357,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,60.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492358,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492359,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,497.16779,[M+FA]-,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492360,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,453.17686,[M+H]+,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492361,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,453.17686,[M+H]+,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492362,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,453.17686,[M+H]+,60.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492363,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,453.17686,[M+H]+,15.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492364,COc1c(-c2cnco2)ccc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)c1,453.17686,[M+H]+,20.0,val,COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
492365,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1,414.14983,[M+H]+,15.0,val,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
492366,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1,414.14983,[M+H]+,15.0,val,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
492367,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1,414.14983,[M+H]+,20.0,val,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
492368,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1,414.14983,[M+H]+,60.0,val,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
492369,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1,414.14983,[M+H]+,15.0,val,Cc1c(CN2CCN(C)CC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
492370,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,478.1627,[M-H]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492371,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,478.1627,[M-H]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492372,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,478.1627,[M-H]-,60.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492373,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,478.1627,[M-H]-,30.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492374,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,478.1627,[M-H]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492375,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,514.13937,[M+Cl]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492376,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,514.13937,[M+Cl]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492377,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,514.13937,[M+Cl]-,60.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492378,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,514.13937,[M+Cl]-,15.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492379,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,514.13937,[M+Cl]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492380,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,524.16818,[M+FA]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492381,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,524.16818,[M+FA]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492382,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,524.16818,[M+FA]-,60.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492383,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,524.16818,[M+FA]-,15.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492384,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,524.16818,[M+FA]-,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492385,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492386,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492387,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,60.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492388,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,30.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492389,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492390,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,60.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492391,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,30.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492392,CC(C)NC(=O)N1CC[C@H](N=C2Nc3c(ccc(F)c3)N(CC(F)F)c3c2cc(Cl)cc3)C1,480.17725,[M+H]+,20.0,val,CC(C)NC(=O)N1CC[C@H](N=C2Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
492393,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,473.19183,[M-H]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492394,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,473.19183,[M-H]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492395,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,473.19183,[M-H]-,30.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492396,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,473.19183,[M-H]-,60.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492397,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,473.19183,[M-H]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492398,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,519.19731,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492399,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,519.19731,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492400,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,519.19731,[M+FA]-,60.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492401,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,519.19731,[M+FA]-,15.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492402,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,519.19731,[M+FA]-,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492403,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492404,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492405,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,60.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492406,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,30.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492407,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492408,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,60.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492409,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,30.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492410,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1c2cc(Nc2ncc(C(F)(F)F)c(NC3CCC3)n2)cc1,475.20639,[M+H]+,20.0,val,CC(=O)NCC(=O)N1[C@@H]2CC[C@H]1c1ccc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)cc12
492411,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,20.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492412,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,20.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492413,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,60.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492414,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,20.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492415,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,60.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492416,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1,393.20852,[M+H]+,20.0,val,CCCn1cc(-c2ccncc2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1
492417,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,20.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492418,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,20.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492419,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,60.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492420,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,20.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492421,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,45.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492422,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,60.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492423,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,20.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492424,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1,489.10335,[M+H]+,45.0,val,O=C1CCC(c2ccccc2)(C2CCN(Cc3ccc(I)cc3)CC2)C(=O)N1
492425,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492426,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492427,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,15.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492428,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,60.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492429,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,30.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492430,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492431,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,60.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492432,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,30.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492433,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492434,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492435,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492436,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,60.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492437,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,30.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492438,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492439,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,60.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492440,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,30.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492441,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1,316.20598,[M+H]+,20.0,val,CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
492442,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,486.11629,[M-H]-,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492443,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,486.11629,[M-H]-,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492444,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,486.11629,[M-H]-,60.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492445,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,486.11629,[M-H]-,15.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492446,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,486.11629,[M-H]-,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492447,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,488.13084,[M+H]+,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492448,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,488.13084,[M+H]+,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492449,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,488.13084,[M+H]+,60.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492450,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,488.13084,[M+H]+,20.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492451,COc1c(S(=O)(=O)Nc2ccc(O)cc2)cc(-c2c(C)nc(NC(=O)C3CCCC3)s2)cc1,488.13084,[M+H]+,45.0,val,COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)Nc1ccc(O)cc1
492452,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492453,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,60.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492454,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,15.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492455,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492456,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,60.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492457,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,15.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492458,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,532.12177,[M+FA]-,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492459,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492460,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492461,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,60.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492462,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492463,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,60.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492464,CC(=O)c1cc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)ccc1,488.13084,[M+H]+,20.0,val,CC(=O)c1cccc(N=c2scc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)n2CCO)c1
492465,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,466.15545,[M-H]-,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492466,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,466.15545,[M-H]-,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492467,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,466.15545,[M-H]-,60.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492468,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,466.15545,[M-H]-,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492469,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,466.15545,[M-H]-,45.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492470,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492471,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492472,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,60.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492473,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,30.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492474,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492475,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,60.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492476,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,30.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492477,COc1cccc(CC(=O)N2Cc3c(cc(S(=O)(=O)Nc4nn(C5CCC5)nc4)cc3)C2)c1,468.17,[M+H]+,20.0,val,COc1cccc(CC(=O)N2Cc3ccc(S(=O)(=O)Nc4cnn(C5CCC5)n4)cc3C2)c1
492478,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492479,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492480,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492481,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492482,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,60.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492483,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492484,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,45.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492485,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,450.17829,[M-H]-,30.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492486,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,450.17829,[M-H]-,30.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492487,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,450.17829,[M-H]-,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492488,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,450.17829,[M-H]-,60.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492489,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,450.17829,[M-H]-,30.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492490,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,15.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492491,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,15.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492492,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,60.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492493,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492494,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,496.18377,[M+FA]-,15.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492495,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492496,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492497,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,60.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492498,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492499,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,45.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492500,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,60.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492501,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,20.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492502,COc1c(OC)cc2c(N)nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc2c1,452.19284,[M+H]+,45.0,val,COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
492503,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,415.21206,[M]+,45.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492504,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,415.21206,[M]+,45.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492505,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,415.21206,[M]+,60.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492506,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,415.21206,[M]+,20.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492507,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,415.21206,[M]+,45.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492508,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,20.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492509,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,20.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492510,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,60.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492511,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,20.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492512,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,45.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492513,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,60.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492514,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,20.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492515,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1,416.21933,[M+H]+,45.0,val,COc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)c3cnn(C)c3n2)cc1
492516,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492517,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492518,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492519,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,30.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492520,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492521,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492522,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,30.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492523,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1,416.21933,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2nc(Nc3ccccc3)c3cnn(C)c3n2)CC1
492524,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,362.17617,[M-H]-,30.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492525,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,364.19072,[M+H]+,20.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492526,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,364.19072,[M+H]+,20.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492527,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,364.19072,[M+H]+,60.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492528,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,364.19072,[M+H]+,15.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492529,Cc1cc2c(cc1)NC(=O)C2(O)CC(=O)c1ccc(C2CCCCC2)cc1,364.19072,[M+H]+,20.0,val,Cc1ccc2c(c1)C(O)(CC(=O)c1ccc(C3CCCCC3)cc1)C(=O)N2
492530,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,20.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492531,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,20.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492532,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,60.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492533,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,15.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492534,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,20.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492535,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,60.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492536,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,15.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492537,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,364.19072,[M+H]+,20.0,val,OCCNCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
492538,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492539,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492540,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,60.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492541,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,30.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492542,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492543,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,30.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492544,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,60.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492545,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1,396.18055,[M+H]+,20.0,val,COc1ccc(CCC(=O)N2CCCC3(C2)OC(=O)c2ccccc23)c(OC)c1
492546,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492547,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492548,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492549,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,30.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492550,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492551,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492552,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,30.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492553,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,448.18535,[M-H]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492554,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,484.16203,[M+Cl]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492555,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,484.16203,[M+Cl]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492556,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,484.16203,[M+Cl]-,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492557,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,484.16203,[M+Cl]-,15.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492558,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,484.16203,[M+Cl]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492559,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,494.19083,[M+FA]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492560,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,494.19083,[M+FA]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492561,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,494.19083,[M+FA]-,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492562,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,494.19083,[M+FA]-,15.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492563,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,494.19083,[M+FA]-,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492564,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492565,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492566,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492567,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,30.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492568,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492569,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,60.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492570,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,30.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492571,O=C(NCc1cc2c(CCC2)[nH]c1=O)NC(c1cc(C(F)(F)F)ccc1)C1CCOCC1,450.1999,[M+H]+,20.0,val,O=C(NCc1cc2c([nH]c1=O)CCC2)NC(c1cccc(C(F)(F)F)c1)C1CCOCC1
492572,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,20.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492573,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,20.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492574,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,60.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492575,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,30.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492576,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,20.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492577,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,60.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492578,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,30.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492579,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1,395.17877,[M+H]+,20.0,val,CCc1ccc(-c2nc(CSCC(=O)NCCc3ccccc3)c(C)o2)cc1
492580,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,20.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492581,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,20.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492582,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,60.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492583,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,30.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492584,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,20.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492585,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,60.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492586,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,30.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492587,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O,395.17877,[M+H]+,20.0,val,CCn1ccc2sc(C)c(C(=O)N3CCC(Cc4ccccc4)CC3)c2c1=O
492588,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492589,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492590,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,60.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492591,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492592,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,45.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492593,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,60.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492594,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492595,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,437.16529,[M-H]-,45.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492596,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492597,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492598,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,60.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492599,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492600,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,45.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492601,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,60.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492602,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,20.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492603,CC(=O)N1CCc2c(cc(S(=O)(=O)Nc3n[nH]c(-c4cc(C)cc(C)c4)c3)cc2)CC1,439.17984,[M+H]+,45.0,val,CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cc(-c4cc(C)cc(C)c4)[nH]n3)cc2CC1
492604,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492605,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492606,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492607,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,30.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492608,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492609,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492610,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,30.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492611,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,437.16529,[M-H]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492612,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,473.14196,[M+Cl]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492613,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,473.14196,[M+Cl]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492614,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,473.14196,[M+Cl]-,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492615,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,473.14196,[M+Cl]-,15.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492616,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,473.14196,[M+Cl]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492617,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492618,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492619,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492620,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,15.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492621,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492622,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492623,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492624,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,483.17076,[M+FA]-,15.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492625,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492626,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492627,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492628,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492629,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492630,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,437.16529,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492631,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492632,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492633,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,45.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492634,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,60.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492635,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492636,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,60.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492637,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,45.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492638,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC,439.17984,[M+H]+,20.0,val,COc1ccc(CC(=O)N2CCN(c3ccc(-c4nc(C)cs4)cn3)CC2)cc1OC
492639,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1
492640,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1
492641,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1
492642,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1
492643,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(-c2ccc3nc(N4CCC(C(=O)N5CCOCC5)CC4)sc3n2)cc1
492644,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,439.17984,[M+H]+,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492645,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,439.17984,[M+H]+,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492646,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,439.17984,[M+H]+,60.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492647,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,439.17984,[M+H]+,30.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492648,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21,439.17984,[M+H]+,20.0,val,CCn1c(C(=O)NCCc2c[nH]c3ccccc23)cc2cc(S(=O)(=O)N(C)C)ccc21
492649,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492650,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492651,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,15.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492652,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492653,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492654,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492655,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492656,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)cc1
492657,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492658,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492659,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,45.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492660,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492661,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492662,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,60.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492663,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,45.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492664,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1,439.17984,[M+H]+,20.0,val,COc1ccc(OCC(=O)N2CCN(c3ccc(-c4nc(C)c(C)s4)cn3)CC2)cc1
492665,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,20.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492666,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,20.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492667,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,45.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492668,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,60.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492669,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,20.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492670,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,45.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492671,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,60.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492672,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O,439.17984,[M+H]+,20.0,val,Cn1c(=O)c2c(SCC(=O)N3CCC(Cc4ccccc4)CC3)ccnc2n(C)c1=O
492673,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,477.14024,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492674,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,477.14024,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492675,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,477.14024,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492676,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,477.14024,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492677,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,477.14024,[M-H]-,45.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492678,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,523.14571,[M+FA]-,20.0,val,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
492679,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,523.14571,[M+FA]-,20.0,val,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
492680,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,523.14571,[M+FA]-,60.0,val,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
492681,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,523.14571,[M+FA]-,15.0,val,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
492682,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,523.14571,[M+FA]-,20.0,val,CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
492683,O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2cc(O)c(O)cc2)O[C@@H]1CO,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO
492684,O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2cc(O)c(O)cc2)O[C@@H]1CO,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO
492685,O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2cc(O)c(O)cc2)O[C@@H]1CO,496.18133,[M+NH4]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO
492686,O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2cc(O)c(O)cc2)O[C@@H]1CO,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO
492687,O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2cc(O)c(O)cc2)O[C@@H]1CO,496.18133,[M+NH4]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO
492688,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,479.15479,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492689,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,479.15479,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492690,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,479.15479,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492691,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,479.15479,[M+H]+,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492692,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,479.15479,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492693,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492694,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492695,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,496.18133,[M+NH4]+,60.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492696,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,496.18133,[M+NH4]+,15.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492697,O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,496.18133,[M+NH4]+,20.0,val,O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
492698,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,492.14623,[M+FA]-,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492699,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,492.14623,[M+FA]-,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492700,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,492.14623,[M+FA]-,60.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492701,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,492.14623,[M+FA]-,15.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492702,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,492.14623,[M+FA]-,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492703,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,448.15531,[M+H]+,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492704,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,448.15531,[M+H]+,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492705,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,448.15531,[M+H]+,60.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492706,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,448.15531,[M+H]+,20.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492707,O=C1CCc2c(cc(OCCCCN3CCN(c4c(Cl)c(Cl)ccc4)CC3)cc2)N1,448.15531,[M+H]+,45.0,val,O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1
492708,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492709,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492710,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,60.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492711,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492712,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,45.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492713,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,60.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492714,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492715,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,45.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492716,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492717,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492718,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,60.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492719,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492720,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,45.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492721,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,60.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492722,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,20.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492723,Cc1c(CCN2CCC(c3noc4c3ccc(F)c4)CC2)c(=O)n2CCCC(O)c2n1,427.214,[M+H]+,45.0,val,Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
492724,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,20.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492725,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,20.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492726,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,60.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492727,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,30.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492728,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,20.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492729,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,60.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492730,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,20.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492731,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1,427.214,[M+H]+,30.0,val,O=C(c1ccc(N2CCOCC2)cc1)N1CC2CCCC2(COc2ncc(F)cn2)C1
492732,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492733,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492734,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492735,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492736,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,45.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492737,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492738,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492739,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,477.17104,[M+Cl]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492740,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,477.17104,[M+Cl]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492741,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,477.17104,[M+Cl]-,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492742,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,477.17104,[M+Cl]-,15.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492743,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,477.17104,[M+Cl]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492744,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,45.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492745,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,45.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492746,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492747,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492748,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,441.19436,[M-H]-,45.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492749,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,441.19436,[M-H]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492750,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,441.19436,[M-H]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492751,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,441.19436,[M-H]-,60.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492752,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,441.19436,[M-H]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492753,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,441.19436,[M-H]-,45.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492754,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,477.17104,[M+Cl]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492755,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,477.17104,[M+Cl]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492756,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,477.17104,[M+Cl]-,60.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492757,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,477.17104,[M+Cl]-,15.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492758,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,477.17104,[M+Cl]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492759,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,487.19984,[M+FA]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492760,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,487.19984,[M+FA]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492761,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,487.19984,[M+FA]-,60.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492762,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,487.19984,[M+FA]-,15.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492763,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,487.19984,[M+FA]-,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492764,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,443.20891,[M+H]+,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492765,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,443.20891,[M+H]+,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492766,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,443.20891,[M+H]+,60.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492767,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,443.20891,[M+H]+,20.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492768,COc1c(OC)cc2c(N[C@@H]3CNC[C@H]3C(C)(C)O)nc(-c3c(O)ccc(F)c3)nc2c1,443.20891,[M+H]+,45.0,val,COc1cc2nc(-c3cc(F)ccc3O)nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC
492769,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492770,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492771,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492772,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,30.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492773,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492774,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492775,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,30.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492776,Cc1c(C(=O)NC[C@H](O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
492777,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492778,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492779,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492780,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,30.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492781,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492782,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,60.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492783,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,30.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492784,Cc1c(C(=O)NCC(O)CN2CCOCC2)c(C)c(/C=C2\C(=O)Nc3c2cc(F)cc3)[nH]1,443.20891,[M+H]+,20.0,val,Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1
492785,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1,407.2354,[M+H]+,20.0,val,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1
492786,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1,407.2354,[M+H]+,20.0,val,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1
492787,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1,407.2354,[M+H]+,60.0,val,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1
492788,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1,407.2354,[M+H]+,30.0,val,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1
492789,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1,407.2354,[M+H]+,20.0,val,CN(Cc1c2c(nn1C)CCCC2)C1CN(c2ccc(-c3ccc(F)cc3)nn2)C1
492790,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,20.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492791,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,20.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492792,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,45.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492793,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,60.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492794,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,20.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492795,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,60.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492796,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,20.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492797,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1,362.22269,[M+H]+,45.0,val,CC(C)N(CCCCO)c1cnc(-c2ccccc2)c(-c2ccccc2)n1
492798,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492799,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492800,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492801,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,30.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492802,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492803,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492804,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,30.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492805,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,376.20305,[M-H]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492806,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492807,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492808,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492809,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,15.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492810,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492811,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492812,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,15.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492813,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,412.17973,[M+Cl]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492814,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,422.20853,[M+FA]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492815,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,422.20853,[M+FA]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492816,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,422.20853,[M+FA]-,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492817,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,422.20853,[M+FA]-,15.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492818,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,422.20853,[M+FA]-,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492819,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492820,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492821,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,60.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492822,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,15.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492823,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492824,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,60.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492825,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,15.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492826,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,422.20853,[M+FA]-,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492827,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492828,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492829,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,60.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492830,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,30.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492831,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492832,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,60.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492833,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,30.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492834,Cc1cnc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(NC(=O)C2CCCN(C(=O)C3(c4ccccc4)CCC3)C2)nc1
492835,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492836,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492837,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492838,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,30.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492839,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492840,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,45.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492841,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,60.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492842,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21,378.2176,[M+H]+,20.0,val,O=C(NC1CCCCCC1CO)C(c1ccccc1)n1cnc2ccccc21
492843,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492844,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492845,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,30.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492846,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,60.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492847,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,15.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492848,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492849,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,60.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492850,O=C(N[C@H]1C[C@@H]1c1cnccc1)C1CCN(C(=O)CCc2ccccc2)CC1,378.2176,[M+H]+,20.0,val,O=C(N[C@H]1C[C@@H]1c1cccnc1)C1CCN(C(=O)CCc2ccccc2)CC1
492851,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,20.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492852,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,20.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492853,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,60.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492854,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,15.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492855,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,20.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492856,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,60.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492857,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,15.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492858,COc1c(CNCCN)ccc(OCc2c(C)c(-c3ccccc3)ccc2)n1,378.2176,[M+H]+,20.0,val,COc1nc(OCc2cccc(-c3ccccc3)c2C)ccc1CNCCN
492859,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,376.20305,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492860,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,376.20305,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492861,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,376.20305,[M-H]-,60.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492862,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,376.20305,[M-H]-,30.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492863,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,376.20305,[M-H]-,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492864,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492865,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492866,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492867,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,30.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492868,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492869,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,60.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492870,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,30.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492871,Cc1cc(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c(C(C)C)cc1,378.2176,[M+H]+,20.0,val,Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccnn2Cc2ccccc2)c1
492872,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,422.20853,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492873,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,422.20853,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492874,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,422.20853,[M+FA]-,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492875,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,422.20853,[M+FA]-,15.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492876,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,422.20853,[M+FA]-,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492877,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,378.2176,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492878,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,378.2176,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492879,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,378.2176,[M+H]+,60.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492880,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,378.2176,[M+H]+,30.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492881,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1,378.2176,[M+H]+,20.0,val,O=C(Nc1ccc2c(c1)CN(C(=O)c1ccccc1)CC2)NC1CCCCC1
492882,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,20.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492883,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,20.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492884,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,60.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492885,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,30.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492886,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,20.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492887,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,60.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492888,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,30.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492889,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1,442.16174,[M+H]+,20.0,val,CC(NS(=O)(=O)c1ccccc1)C(c1cccs1)N1CCN(c2ccccc2)CC1
492890,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,404.2092,[M-H]-,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492891,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,404.2092,[M-H]-,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492892,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,404.2092,[M-H]-,60.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492893,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,404.2092,[M-H]-,30.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492894,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,404.2092,[M-H]-,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492895,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,404.2092,[M-H]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492896,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,404.2092,[M-H]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492897,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,404.2092,[M-H]-,60.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492898,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,404.2092,[M-H]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492899,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,404.2092,[M-H]-,45.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492900,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,450.21468,[M+FA]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492901,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,450.21468,[M+FA]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492902,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,450.21468,[M+FA]-,60.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492903,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,450.21468,[M+FA]-,15.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492904,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,450.21468,[M+FA]-,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492905,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492906,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492907,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,60.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492908,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,30.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492909,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492910,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,60.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492911,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,30.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492912,COc1cccc(CC2CCCN2C(=O)Nc2cnc(-n3nc(C)cc3C)cc2)c1,406.22375,[M+H]+,20.0,val,COc1cccc(CC2CCCN2C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1
492913,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492914,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492915,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,60.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492916,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,30.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492917,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492918,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,60.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492919,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,30.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492920,Cc1nc2n[nH]c(C)c2c(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c1,406.22375,[M+H]+,20.0,val,Cc1cc(C(=O)NC2CC3(CCN(C)CC3)Oc3ccccc32)c2c(C)[nH]nc2n1
492921,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492922,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492923,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,60.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492924,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492925,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,60.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492926,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,404.2092,[M-H]-,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492927,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492928,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492929,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492930,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492931,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492932,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492933,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492934,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492935,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492936,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492937,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492938,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492939,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492940,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492941,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492942,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492943,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492944,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492945,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,60.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492946,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492947,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,45.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492948,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,60.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492949,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,20.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492950,Cc1nc2c(cc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2)[nH]1,406.22375,[M+H]+,45.0,val,Cc1nc2ccc(C(=O)N3CCC4(CC3)CC(=O)c3c(cnn3C(C)C)C4)cc2[nH]1
492951,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492952,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492953,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492954,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492955,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492956,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,60.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492957,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,30.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492958,COc1nc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)ncc1,406.22375,[M+H]+,20.0,val,COc1ccnc(N2CCC3(CCCN(Cc4c[nH]c5ccccc45)C3=O)CC2)n1
492959,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,404.2092,[M-H]-,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492960,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,404.2092,[M-H]-,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492961,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,404.2092,[M-H]-,60.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492962,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,404.2092,[M-H]-,45.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492963,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,450.21468,[M+FA]-,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492964,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,450.21468,[M+FA]-,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492965,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,450.21468,[M+FA]-,60.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492966,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,450.21468,[M+FA]-,30.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492967,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,450.21468,[M+FA]-,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492968,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,406.22375,[M+H]+,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492969,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,406.22375,[M+H]+,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492970,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,406.22375,[M+H]+,60.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492971,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,406.22375,[M+H]+,30.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492972,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3c([nH]2)c2c(cccn2)cc3)CC1,406.22375,[M+H]+,20.0,val,NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
492973,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,20.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492974,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,20.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492975,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,45.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492976,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,60.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492977,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,20.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492978,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,60.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492979,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,45.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492980,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1,438.21358,[M+H]+,20.0,val,COc1ccc(-c2nc3cnccn3c2NCCC(=O)N2CCC3(CC2)OCCO3)cc1
492981,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,20.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492982,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,20.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492983,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,45.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492984,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,60.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492985,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,20.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492986,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,45.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492987,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,60.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492988,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1,438.21358,[M+H]+,20.0,val,CCOC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c3oc3ccccc34)CC2)CC1
492989,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,516.15901,[M-H]-,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492990,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,516.15901,[M-H]-,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492991,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,516.15901,[M-H]-,60.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492992,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,516.15901,[M-H]-,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492993,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,516.15901,[M-H]-,45.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492994,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,518.17356,[M+H]+,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492995,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,518.17356,[M+H]+,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492996,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,518.17356,[M+H]+,60.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492997,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,518.17356,[M+H]+,20.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492998,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2c(OC)cc(N3CCN(C)CC3)cc2)ncc1Cl,518.17356,[M+H]+,45.0,val,CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)ncc1Cl
492999,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,20.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493000,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,20.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493001,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,60.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493002,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,30.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493003,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,20.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493004,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,60.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493005,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,30.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493006,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1,430.21366,[M+H]+,20.0,val,O=C(COc1coc(CN2CCN(c3ccccc3F)CC2)cc1=O)NC1CCCC1
493007,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,395.19763,[M-H]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493008,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,395.19763,[M-H]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493009,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,395.19763,[M-H]-,60.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493010,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,395.19763,[M-H]-,30.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493011,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,395.19763,[M-H]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493012,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,441.20311,[M+FA]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493013,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,441.20311,[M+FA]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493014,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,441.20311,[M+FA]-,60.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493015,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,441.20311,[M+FA]-,15.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493016,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,441.20311,[M+FA]-,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493017,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,397.21218,[M+H]+,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493018,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,397.21218,[M+H]+,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493019,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,397.21218,[M+H]+,60.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493020,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,397.21218,[M+H]+,15.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493021,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,397.21218,[M+H]+,20.0,val,COC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
493022,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,395.19763,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493023,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,395.19763,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493024,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,395.19763,[M-H]-,45.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493025,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,395.19763,[M-H]-,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493026,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,395.19763,[M-H]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493027,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,441.20311,[M+FA]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493028,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,441.20311,[M+FA]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493029,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,441.20311,[M+FA]-,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493030,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,441.20311,[M+FA]-,30.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493031,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,441.20311,[M+FA]-,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493032,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493033,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493034,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,45.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493035,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493036,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493037,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,45.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493038,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493039,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,395.19763,[M-H]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493040,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,431.17431,[M+Cl]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493041,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,431.17431,[M+Cl]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493042,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,431.17431,[M+Cl]-,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493043,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,431.17431,[M+Cl]-,15.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493044,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,431.17431,[M+Cl]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493045,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,441.20311,[M+FA]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493046,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,441.20311,[M+FA]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493047,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,441.20311,[M+FA]-,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493048,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,441.20311,[M+FA]-,15.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493049,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,441.20311,[M+FA]-,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493050,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,395.19763,[M-H]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493051,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,395.19763,[M-H]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493052,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,395.19763,[M-H]-,60.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493053,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,395.19763,[M-H]-,30.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493054,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,395.19763,[M-H]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493055,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,431.17431,[M+Cl]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493056,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,431.17431,[M+Cl]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493057,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,431.17431,[M+Cl]-,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493058,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493059,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493060,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,30.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493061,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,60.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493062,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493063,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,45.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493064,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,20.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493065,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1,397.21218,[M+H]+,60.0,val,COc1ccccc1OC(C)C(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1
493066,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493067,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493068,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493069,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,30.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493070,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493071,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,60.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493072,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,30.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493073,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1,397.21218,[M+H]+,20.0,val,CC(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCC2CCCO2)cc1
493074,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493075,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493076,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493077,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493078,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493079,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493080,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,45.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493081,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1,397.21218,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)cc1
493082,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,527.14063,[M-H]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493083,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,527.14063,[M-H]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493084,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,527.14063,[M-H]-,60.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493085,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,527.14063,[M-H]-,30.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493086,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,527.14063,[M-H]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493087,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,563.11731,[M+Cl]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493088,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,563.11731,[M+Cl]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493089,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,563.11731,[M+Cl]-,60.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493090,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,563.11731,[M+Cl]-,30.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493091,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,563.11731,[M+Cl]-,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493092,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,546.18173,[M+NH4]+,15.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493093,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,546.18173,[M+NH4]+,15.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493094,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,546.18173,[M+NH4]+,20.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493095,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,546.18173,[M+NH4]+,60.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493096,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1,546.18173,[M+NH4]+,15.0,val,C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)c1cc(O)c(O)c(O)c1
493097,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1,450.21224,[M+NH4]+,20.0,val,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1
493098,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1,450.21224,[M+NH4]+,20.0,val,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1
493099,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1,450.21224,[M+NH4]+,60.0,val,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1
493100,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1,450.21224,[M+NH4]+,15.0,val,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1
493101,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1,450.21224,[M+NH4]+,20.0,val,COC(=O)C1=CC[C@@]23CC[C@@H]([C@@](C)(/C=C/C=C(\C)C(=O)O)OC2=O)[C@@]3(OC(C)=O)CC1
493102,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,431.17114,[M-H]-,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493103,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,431.17114,[M-H]-,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493104,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,431.17114,[M-H]-,60.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493105,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,431.17114,[M-H]-,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493106,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,431.17114,[M-H]-,45.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493107,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493108,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493109,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,60.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493110,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,15.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493111,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493112,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,60.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493113,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,15.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493114,CC(=O)OC(CCc1cc(O)c(O)cc1)CC(CCc1cc(O)c(O)cc1)OC(C)=O,450.21224,[M+NH4]+,20.0,val,CC(=O)OC(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC(C)=O
493115,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,477.17662,[M+FA]-,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493116,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,477.17662,[M+FA]-,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493117,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,477.17662,[M+FA]-,60.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493118,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,477.17662,[M+FA]-,15.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493119,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,477.17662,[M+FA]-,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493120,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,433.18569,[M+H]+,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493121,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,433.18569,[M+H]+,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493122,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,433.18569,[M+H]+,60.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493123,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,433.18569,[M+H]+,15.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493124,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,433.18569,[M+H]+,20.0,val,COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
493125,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493126,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493127,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,15.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493128,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493129,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,15.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493130,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,480.23648,[M+FA]-,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493131,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493132,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493133,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,60.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493134,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,30.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493135,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493136,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,60.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493137,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,30.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493138,Cc1c(CNC(=O)N2CC(OC(C)C)C2)ccc(-c2nc(Nc3cn(C)nc3)ncc2)c1,436.24555,[M+H]+,20.0,val,Cc1cc(-c2ccnc(Nc3cnn(C)c3)n2)ccc1CNC(=O)N1CC(OC(C)C)C1
493139,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1,436.24555,[M+H]+,30.0,val,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1
493140,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1,436.24555,[M+H]+,30.0,val,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1
493141,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1,436.24555,[M+H]+,20.0,val,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1
493142,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1,436.24555,[M+H]+,60.0,val,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1
493143,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1,436.24555,[M+H]+,30.0,val,NC(=O)C1CCN(C(=O)CCc2nnc3c(N4CCCCC4)nc4ccccc4n23)CC1
493144,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493145,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493146,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,60.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493147,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493148,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,60.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493149,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493150,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493151,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,60.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493152,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,20.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493153,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1,427.21622,[M+H]+,45.0,val,O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN(c2nsc3ccccc23)CC1
493154,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,20.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493155,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,20.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493156,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,45.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493157,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,60.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493158,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,20.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493159,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,45.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493160,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,60.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493161,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1,411.22131,[M+H]+,20.0,val,O=C(NCCN1CCCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1
493162,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1,411.22131,[M+H]+,20.0,val,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1
493163,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1,411.22131,[M+H]+,20.0,val,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1
493164,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1,411.22131,[M+H]+,60.0,val,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1
493165,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1,411.22131,[M+H]+,30.0,val,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1
493166,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1,411.22131,[M+H]+,20.0,val,CCCN1CCN(C(=O)c2ccc(-c3ccc(N4CCSCC4)nc3)cc2)CC1
493167,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,501.15705,[M-H]-,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493168,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,501.15705,[M-H]-,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493169,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,501.15705,[M-H]-,60.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493170,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,501.15705,[M-H]-,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493171,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,501.15705,[M-H]-,45.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493172,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,537.13372,[M+Cl]-,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493173,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,537.13372,[M+Cl]-,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493174,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,503.1716,[M+H]+,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493175,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,503.1716,[M+H]+,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493176,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,503.1716,[M+H]+,60.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493177,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,503.1716,[M+H]+,30.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493178,CSc1c(NC(=O)CN2CCN(CCSc3nc4ccccc4[nH]3)CC2)c(SC)nc(C)c1,503.1716,[M+H]+,20.0,val,CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCSc2nc3ccccc3[nH]2)CC1
493179,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12,463.19736,[M+FA]-,20.0,val,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12
493180,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12,463.19736,[M+FA]-,20.0,val,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12
493181,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12,463.19736,[M+FA]-,60.0,val,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12
493182,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12,463.19736,[M+FA]-,15.0,val,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12
493183,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12,463.19736,[M+FA]-,20.0,val,CC(O)C(=O)/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12
493184,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,383.18531,[M+H-2H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493185,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,383.18531,[M+H-2H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493186,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,383.18531,[M+H-2H2O]+,30.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493187,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,383.18531,[M+H-2H2O]+,60.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493188,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,383.18531,[M+H-2H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493189,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,401.19587,[M+H-H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493190,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,401.19587,[M+H-H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493191,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,401.19587,[M+H-H2O]+,60.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493192,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,401.19587,[M+H-H2O]+,15.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493193,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,401.19587,[M+H-H2O]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493194,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,436.23298,[M+NH4]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493195,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,436.23298,[M+NH4]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493196,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,436.23298,[M+NH4]+,60.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493197,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,436.23298,[M+NH4]+,15.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493198,COC(=O)C1(C)CCC(=O)C2(C)c3c(cc(C(C)C)cc3O)C(O)C(OC(C)=O)C12,436.23298,[M+NH4]+,20.0,val,COC(=O)C1(C)CCC(=O)C2(C)c3c(O)cc(C(C)C)cc3C(O)C(OC(C)=O)C12
493199,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1,401.19587,[M+H-H2O]+,20.0,val,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1
493200,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1,401.19587,[M+H-H2O]+,20.0,val,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1
493201,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1,401.19587,[M+H-H2O]+,60.0,val,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1
493202,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1,401.19587,[M+H-H2O]+,15.0,val,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1
493203,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1,401.19587,[M+H-H2O]+,20.0,val,C=CCc1cc(OC)c(OC(C)C(O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1
493204,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,419.20643,[M+H]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493205,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,419.20643,[M+H]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493206,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,419.20643,[M+H]+,60.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493207,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,419.20643,[M+H]+,30.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493208,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,419.20643,[M+H]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493209,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,436.23298,[M+NH4]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493210,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,436.23298,[M+NH4]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493211,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,436.23298,[M+NH4]+,60.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493212,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,436.23298,[M+NH4]+,15.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493213,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3c(C)c(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O,436.23298,[M+NH4]+,20.0,val,CC[C@H]1O[C@@H]2O[C@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O
493214,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493215,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493216,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,60.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493217,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,15.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493218,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493219,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,60.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493220,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,15.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493221,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,477.17326,[M-H]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493222,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,513.14994,[M+Cl]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493223,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,513.14994,[M+Cl]-,15.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493224,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,523.17874,[M+FA]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493225,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,523.17874,[M+FA]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493226,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,523.17874,[M+FA]-,60.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493227,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,523.17874,[M+FA]-,15.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493228,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,523.17874,[M+FA]-,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493229,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493230,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493231,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,60.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493232,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,30.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493233,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493234,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,60.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493235,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,30.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493236,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1,479.18782,[M+H]+,20.0,val,CCCCCNC(=O)N1CCC(CN(Cc2ccc(Cl)cc2)Cc2ccc([N+](=O)[O-])s2)C1
493237,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493238,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493239,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493240,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,15.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493241,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493242,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,15.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493243,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493244,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493245,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493246,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493247,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,30.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493248,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493249,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493250,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493251,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493252,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,15.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493253,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493254,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493255,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,15.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493256,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493257,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493258,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493259,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493260,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,15.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493261,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493262,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,15.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493263,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493264,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,396.21151,[M-H]-,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493265,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493266,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493267,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,30.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493268,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,432.18819,[M+Cl]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493269,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493270,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493271,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493272,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,15.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493273,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493274,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493275,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,442.21699,[M+FA]-,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493276,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493277,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493278,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493279,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,30.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493280,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493281,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,60.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493282,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,30.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493283,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@@H]1CCCC[C@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493284,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493285,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493286,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493287,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,30.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493288,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493289,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,60.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493290,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,30.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493291,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1,398.22606,[M+H]+,20.0,val,CN(C)[C@H]1CCCC[C@@H]1NC(=S)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1
493292,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493293,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493294,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493295,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,30.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493296,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493297,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,60.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493298,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,30.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493299,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1,398.22606,[M+H]+,20.0,val,CN1CCN(CC#CCOC2CCN(Cc3csc4ccccc34)CC2)CC1
493300,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,20.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493301,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,20.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493302,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,60.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493303,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,30.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493304,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,20.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493305,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,60.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493306,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,30.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493307,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2,442.22712,[M+H]+,20.0,val,CC(=O)N1CCN(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)CC12CCCCC2
493308,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1,442.22712,[M+H]+,20.0,val,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1
493309,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1,442.22712,[M+H]+,20.0,val,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1
493310,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1,442.22712,[M+H]+,60.0,val,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1
493311,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1,442.22712,[M+H]+,30.0,val,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1
493312,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1,442.22712,[M+H]+,20.0,val,CN1CCN(C(=O)c2cc(-c3cccs3)n(CC(=O)NCCC3=CCCCC3)n2)CC1
493313,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493314,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493315,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493316,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,30.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493317,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493318,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,60.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493319,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,20.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493320,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1,442.22712,[M+H]+,30.0,val,COc1ccccc1N1CCN(c2cc(SCC(=O)NC3CCCCC3)ncn2)CC1
493321,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,20.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
493322,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,20.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
493323,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,60.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
493324,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,20.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
493325,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,45.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
493326,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1,433.23331,[M+H]+,60.0,val,OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
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493329,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493330,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493331,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,45.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493332,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,60.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493333,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493334,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,60.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493335,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,20.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493336,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O,413.25472,[M+H]+,45.0,val,CN1CC2(CC3CCC(C2)N3CC(=O)N2CCN(c3ccccc3)CC2)OCC1=O
493337,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,20.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493338,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,20.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493339,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,60.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493340,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,30.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493341,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,20.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493342,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,60.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493343,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,30.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
493344,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2c(C1)scn2,415.25261,[M+H]+,20.0,val,CCCN(CCN1CCN(c2ccccc2OC)CC1)C1CCc2ncsc2C1
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493378,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,20.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493379,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,20.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493380,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,60.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493381,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,15.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493382,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,20.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493383,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,60.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493384,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,15.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493385,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,552.22868,[M+NH4]+,20.0,val,COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
493386,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1,429.29725,[M+H]+,20.0,val,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1
493387,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1,429.29725,[M+H]+,20.0,val,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1
493388,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1,429.29725,[M+H]+,45.0,val,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1
493389,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1,429.29725,[M+H]+,60.0,val,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1
493390,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1,429.29725,[M+H]+,20.0,val,CC1CN(C2CCCCC2)c2nc3c(c(=O)n(CCN4CCCCC4)c(=O)n3C)n2C1
493391,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493392,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493393,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,60.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493394,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,30.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493395,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493396,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,60.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493397,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,30.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493398,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,503.2134,[M-H]-,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493399,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,487.21739,[M+H-H2O]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493400,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,487.21739,[M+H-H2O]+,60.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493401,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,487.21739,[M+H-H2O]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493402,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,487.21739,[M+H-H2O]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493403,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,505.22795,[M+H]+,30.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493404,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,505.22795,[M+H]+,30.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493405,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,505.22795,[M+H]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493406,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,505.22795,[M+H]+,60.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493407,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,505.22795,[M+H]+,30.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493408,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,522.2545,[M+NH4]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493409,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,522.2545,[M+NH4]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493410,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,522.2545,[M+NH4]+,60.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493411,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,522.2545,[M+NH4]+,15.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493412,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,522.2545,[M+NH4]+,20.0,val,C=CC(C)(CC/C=C(\C)C(=O)OC)OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O
493413,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,511.27734,[M+FA]-,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493414,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,511.27734,[M+FA]-,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493415,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,511.27734,[M+FA]-,60.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493416,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,511.27734,[M+FA]-,15.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493417,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,511.27734,[M+FA]-,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493418,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493419,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493420,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,60.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493421,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,30.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493422,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493423,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,60.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493424,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,30.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493425,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O,467.28641,[M+H]+,20.0,val,CC(C)C(C(=O)N(C)C(C)C(N)=O)N(C)C(=O)C1CCCN1C(=O)/C=C/C=C/C(O)C(C)O
493426,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493427,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493428,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,60.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493429,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,15.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493430,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493431,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,60.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493432,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,15.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493433,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,505.11047,[M-H]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493434,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493435,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493436,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,60.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493437,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,15.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493438,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493439,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,60.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493440,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,15.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493441,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cc(C(F)(F)F)ccc2)cc1,541.08715,[M+Cl]-,20.0,val,N#Cc1ccc(C/C(=N/NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2cccc(C(F)(F)F)c2)cc1
493442,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1,443.11724,[M+H]+,20.0,val,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1
493443,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1,443.11724,[M+H]+,20.0,val,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1
493444,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1,443.11724,[M+H]+,60.0,val,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1
493445,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1,443.11724,[M+H]+,30.0,val,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1
493446,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1,443.11724,[M+H]+,20.0,val,O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(Cc1ccccn1)c1nc2ccccc2s1
493447,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493448,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493449,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,60.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493450,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,30.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493451,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493452,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,60.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493453,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,30.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493454,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21,452.11717,[M+H]+,20.0,val,CCOc1ccccc1NC(=O)Cn1c(=O)nc(-c2ccccc2F)c2cc(Cl)ccc21
493455,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,478.10877,[M-H]-,20.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493456,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,478.10877,[M-H]-,20.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493457,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,478.10877,[M-H]-,60.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493458,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,478.10877,[M-H]-,20.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493459,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,478.10877,[M-H]-,45.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493460,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,514.08545,[M+Cl]-,20.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493461,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,514.08545,[M+Cl]-,20.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493462,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1,514.08545,[M+Cl]-,60.0,val,N#Cc1ccc(Cn2nc(-c3cc(Cl)c(NCC(O)CO)nc3F)c3ccccc3c2=O)cc1
493463,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,480.13765,[M+FA]-,20.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493464,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,480.13765,[M+FA]-,60.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493465,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,480.13765,[M+FA]-,15.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493466,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,480.13765,[M+FA]-,20.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493467,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,436.14672,[M+H]+,20.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493468,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,436.14672,[M+H]+,20.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493469,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,436.14672,[M+H]+,60.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493470,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,436.14672,[M+H]+,30.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493471,Cc1noc2c1c(C(=O)N1CCOC(c3cc(F)ccc3)C1)cc(-c1ccc(F)cc1)n2,436.14672,[M+H]+,20.0,val,Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCOC(c4cccc(F)c4)C3)c12
493472,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493473,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493474,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,60.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493475,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,30.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493476,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493477,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,60.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493478,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,30.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493479,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,401.1307,[M-H]-,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493480,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,403.14525,[M+H]+,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493481,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,403.14525,[M+H]+,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493482,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,403.14525,[M+H]+,60.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493483,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,403.14525,[M+H]+,30.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493484,O=C(O)Cn1c2c(CN(C(=O)c3cccc4ccccc34)CC2)c2c1ccc(F)c2,403.14525,[M+H]+,20.0,val,O=C(O)Cn1c2c(c3cc(F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2
493485,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,477.14922,[M-H]-,20.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493486,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,477.14922,[M-H]-,60.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493487,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,477.14922,[M-H]-,20.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493488,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,477.14922,[M-H]-,45.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493489,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,479.16377,[M+H]+,20.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493490,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,479.16377,[M+H]+,20.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493491,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,479.16377,[M+H]+,60.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493492,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,479.16377,[M+H]+,20.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493493,O=C(c1c(F)ccc(Cn2c(=O)[nH]c(=O)c3c2cccc3F)c1)N1CCN(c2ncccn2)CC1,479.16377,[M+H]+,45.0,val,O=C(c1cc(Cn2c(=O)[nH]c(=O)c3c(F)cccc32)ccc1F)N1CCN(c2ncccn2)CC1
493494,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1,434.15106,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1
493495,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1,434.15106,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1
493496,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1,434.15106,[M+H]+,60.0,val,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1
493497,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1,434.15106,[M+H]+,20.0,val,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1
493498,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1,434.15106,[M+H]+,60.0,val,COc1ccc(C(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)c(OC)c1
493499,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493500,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493501,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,60.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493502,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,15.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493503,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,60.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493504,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,15.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493505,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493506,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493507,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,60.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493508,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,15.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493509,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493510,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,60.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493511,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,15.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493512,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,510.07592,[M-H]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493513,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,546.05259,[M+Cl]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493514,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,546.05259,[M+Cl]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493515,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,546.05259,[M+Cl]-,60.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493516,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,546.05259,[M+Cl]-,15.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493517,C[C@H](c1c(CCCC(=O)O)cc(F)cc1)N(c1c(F)ccc(F)c1)S(=O)(=O)c1ccc(Cl)cc1,546.05259,[M+Cl]-,20.0,val,C[C@H](c1ccc(F)cc1CCCC(=O)O)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
493518,Fc1cccc(-c2nnc(C(c3cc(Cl)ccc3)N3CCN(c4ccccn4)CC3)o2)c1,450.14914,[M+H]+,20.0,val,Fc1cccc(-c2nnc(C(c3cccc(Cl)c3)N3CCN(c4ccccn4)CC3)o2)c1
493519,Fc1cccc(-c2nnc(C(c3cc(Cl)ccc3)N3CCN(c4ccccn4)CC3)o2)c1,450.14914,[M+H]+,20.0,val,Fc1cccc(-c2nnc(C(c3cccc(Cl)c3)N3CCN(c4ccccn4)CC3)o2)c1
493520,Fc1cccc(-c2nnc(C(c3cc(Cl)ccc3)N3CCN(c4ccccn4)CC3)o2)c1,450.14914,[M+H]+,60.0,val,Fc1cccc(-c2nnc(C(c3cccc(Cl)c3)N3CCN(c4ccccn4)CC3)o2)c1
493521,Fc1cccc(-c2nnc(C(c3cc(Cl)ccc3)N3CCN(c4ccccn4)CC3)o2)c1,450.14914,[M+H]+,30.0,val,Fc1cccc(-c2nnc(C(c3cccc(Cl)c3)N3CCN(c4ccccn4)CC3)o2)c1
493522,Fc1cccc(-c2nnc(C(c3cc(Cl)ccc3)N3CCN(c4ccccn4)CC3)o2)c1,450.14914,[M+H]+,20.0,val,Fc1cccc(-c2nnc(C(c3cccc(Cl)c3)N3CCN(c4ccccn4)CC3)o2)c1
493523,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1,419.11679,[M-H]-,20.0,val,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1
493524,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1,419.11679,[M-H]-,20.0,val,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1
493525,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1,419.11679,[M-H]-,60.0,val,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1
493526,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1,419.11679,[M-H]-,15.0,val,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1
493527,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1,419.11679,[M-H]-,20.0,val,CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OCc2ccc(C#N)cc2)cc1
493528,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493529,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493530,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493531,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,30.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493532,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493533,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493534,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,30.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493535,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,419.11679,[M-H]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493536,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,455.09347,[M+Cl]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493537,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,455.09347,[M+Cl]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493538,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,455.09347,[M+Cl]-,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493539,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,455.09347,[M+Cl]-,15.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493540,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,455.09347,[M+Cl]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493541,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,465.12227,[M+FA]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493542,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,465.12227,[M+FA]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493543,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,465.12227,[M+FA]-,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493544,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,465.12227,[M+FA]-,15.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493545,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,465.12227,[M+FA]-,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493546,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493547,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493548,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,45.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493549,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493550,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493551,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,45.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493552,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,60.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493553,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2,421.13135,[M+H]+,20.0,val,O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CCC2
493554,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493555,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493556,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,60.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493557,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493558,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,60.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493559,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,455.17496,[M-H]-,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493560,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493561,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493562,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,60.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493563,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493564,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,45.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493565,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,60.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493566,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,20.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493567,O=C(Nc1cc2c(cc1)nc(-c1cc(F)ccc1)[nH]2)C1CCN(c2nn3cnnc3cc2)CC1,457.18951,[M+H]+,45.0,val,O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)C1CCN(c2ccc3nncn3n2)CC1
493568,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,478.12876,[M-H]-,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493569,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,478.12876,[M-H]-,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493570,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,478.12876,[M-H]-,60.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493571,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,478.12876,[M-H]-,30.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493572,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,478.12876,[M-H]-,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493573,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,480.14331,[M+H]+,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493574,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,480.14331,[M+H]+,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493575,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,480.14331,[M+H]+,60.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493576,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,480.14331,[M+H]+,15.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493577,COc1c(NC(=O)Cn2c(=O)n(CCc3ccccc3)c(=O)c3nccnc32)cc(C)c(Cl)c1,480.14331,[M+H]+,20.0,val,COc1cc(Cl)c(C)cc1NC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2nccnc21
493578,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493579,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493580,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,60.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493581,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,30.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493582,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493583,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,60.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493584,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,30.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493585,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,449.13542,[M-H]-,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493586,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,451.14998,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493587,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,451.14998,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493588,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,451.14998,[M+H]+,60.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493589,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,451.14998,[M+H]+,30.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493590,Cc1cc(=O)oc2c1ccc(OC(C)C(=O)NC(Cc1c[nH]c3c1cc(O)cc3)C(=O)O)c2,451.14998,[M+H]+,20.0,val,Cc1cc(=O)oc2cc(OC(C)C(=O)NC(Cc3c[nH]c4ccc(O)cc34)C(=O)O)ccc12
493591,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,20.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493592,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,20.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493593,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,60.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493594,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,20.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493595,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,45.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493596,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,60.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493597,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,20.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493598,CN1CCN(c2nnc(-c3cc4ccccc4cc3)c(-c3ccncc3)c2)CC1,382.20262,[M+H]+,45.0,val,CN1CCN(c2cc(-c3ccncc3)c(-c3ccc4ccccc4c3)nn2)CC1
493599,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,472.15612,[M-H]-,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493600,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493601,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493602,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493603,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,15.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493604,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493605,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,60.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493606,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,15.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493607,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C,474.17067,[M+H]+,20.0,val,CNC(=O)NC(=O)CSc1nnc(-c2nn(-c3ccccc3)c3c2CCc2ccccc2-3)n1C
493608,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,436.12242,[M-H]-,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493609,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,436.12242,[M-H]-,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493610,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,436.12242,[M-H]-,60.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493611,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,436.12242,[M-H]-,30.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493612,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,436.12242,[M-H]-,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493613,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493614,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493615,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,60.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493616,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493617,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,45.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493618,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,60.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493619,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,20.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493620,CO[C@@H](Cc1c2sccc2c(OCCc2c(C)oc(-c3ccccc3)n2)cc1)C(=O)O,438.13697,[M+H]+,45.0,val,CO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O
493621,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493622,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493623,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,60.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493624,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,30.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493625,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493626,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,60.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493627,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,30.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493628,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493629,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493630,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493631,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,60.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493632,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,30.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493633,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493634,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,60.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493635,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,30.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493636,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2,488.1904,[M+H]+,20.0,val,Cc1cc(-c2nc(CN3CCNCC3)no2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2
493637,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493638,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493639,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493640,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,30.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493641,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493642,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493643,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,30.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493644,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,399.18265,[M-H]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493645,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,435.15933,[M+Cl]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493646,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,435.15933,[M+Cl]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493647,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,435.15933,[M+Cl]-,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493648,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,435.15933,[M+Cl]-,15.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493649,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,435.15933,[M+Cl]-,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493650,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,383.18664,[M+H-H2O]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493651,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,383.18664,[M+H-H2O]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493652,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,383.18664,[M+H-H2O]+,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493653,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,383.18664,[M+H-H2O]+,30.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493654,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,383.18664,[M+H-H2O]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493655,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493656,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493657,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493658,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,30.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493659,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493660,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,60.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493661,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,30.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493662,O=C(CCc1nc2c(cccn2)[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1,401.1972,[M+H]+,20.0,val,O=C(CCc1nc2ncccc2[nH]1)N(Cc1ccccc1)CC(O)c1ccccc1
493663,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493664,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493665,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,60.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493666,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,30.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493667,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493668,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,60.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493669,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,30.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493670,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493671,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493672,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493673,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,60.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493674,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,15.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493675,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493676,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493677,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493678,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,60.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493679,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,30.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493680,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,399.18265,[M-H]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493681,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493682,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493683,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,60.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493684,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,15.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493685,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,445.18813,[M+FA]-,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493686,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493687,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493688,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,60.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493689,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,30.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493690,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493691,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,60.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493692,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,30.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493693,Cc1c2c(n[nH]1)OC(N)=C(C#N)C2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1C(c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493694,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493695,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493696,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,60.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493697,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,30.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493698,Cc1c2c(n[nH]1)OC(N)=C(C#N)[C@]2(c1cc(CO)cc(-c2ccccc2)c1)C(C)C,401.1972,[M+H]+,20.0,val,Cc1[nH]nc2c1[C@@](c1cc(CO)cc(-c3ccccc3)c1)(C(C)C)C(C#N)=C(N)O2
493699,Cc1c(-c2ccc(O)cc2)c(=O)n2[nH]c(-c3ccccc3)c(N3CCCCC3)c2n1,401.1972,[M+H]+,20.0,val,Cc1nc2c(N3CCCCC3)c(-c3ccccc3)[nH]n2c(=O)c1-c1ccc(O)cc1
493700,Cc1c(-c2ccc(O)cc2)c(=O)n2[nH]c(-c3ccccc3)c(N3CCCCC3)c2n1,401.1972,[M+H]+,20.0,val,Cc1nc2c(N3CCCCC3)c(-c3ccccc3)[nH]n2c(=O)c1-c1ccc(O)cc1
493701,Cc1c(-c2ccc(O)cc2)c(=O)n2[nH]c(-c3ccccc3)c(N3CCCCC3)c2n1,401.1972,[M+H]+,60.0,val,Cc1nc2c(N3CCCCC3)c(-c3ccccc3)[nH]n2c(=O)c1-c1ccc(O)cc1
493702,Cc1c(-c2ccc(O)cc2)c(=O)n2[nH]c(-c3ccccc3)c(N3CCCCC3)c2n1,401.1972,[M+H]+,20.0,val,Cc1nc2c(N3CCCCC3)c(-c3ccccc3)[nH]n2c(=O)c1-c1ccc(O)cc1
493703,Cc1c(-c2ccc(O)cc2)c(=O)n2[nH]c(-c3ccccc3)c(N3CCCCC3)c2n1,401.1972,[M+H]+,45.0,val,Cc1nc2c(N3CCCCC3)c(-c3ccccc3)[nH]n2c(=O)c1-c1ccc(O)cc1
493704,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,399.18265,[M-H]-,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493705,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,399.18265,[M-H]-,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493706,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,399.18265,[M-H]-,60.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493707,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,399.18265,[M-H]-,30.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493708,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,399.18265,[M-H]-,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493709,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,401.1972,[M+H]+,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493710,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,401.1972,[M+H]+,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493711,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,401.1972,[M+H]+,60.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493712,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,401.1972,[M+H]+,20.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493713,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1,401.1972,[M+H]+,60.0,val,CCOc1ccc(Nc2nc3ccccc3nc2Nc2ccc(OCC)cc2)cc1
493714,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493715,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493716,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,75.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493717,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,60.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493718,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493719,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,60.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493720,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493721,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,399.18265,[M-H]-,75.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493722,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,401.1972,[M+H]+,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493723,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,401.1972,[M+H]+,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493724,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,401.1972,[M+H]+,60.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493725,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,401.1972,[M+H]+,20.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493726,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1,401.1972,[M+H]+,60.0,val,Cc1ccc(-n2[nH]c3c(cnc4ccc(C(=O)NC5CCCCC5)cc43)c2=O)cc1
493727,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1,449.16419,[M+H]+,20.0,val,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1
493728,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1,449.16419,[M+H]+,20.0,val,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1
493729,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1,449.16419,[M+H]+,60.0,val,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1
493730,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1,449.16419,[M+H]+,30.0,val,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1
493731,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1,449.16419,[M+H]+,20.0,val,Cc1cc(C)c2nc(N(CCCn3ccnc3)C(=O)C3COc4ccccc4O3)sc2c1
493732,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O,449.16419,[M+H]+,20.0,val,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O
493733,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O,449.16419,[M+H]+,20.0,val,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O
493734,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O,449.16419,[M+H]+,60.0,val,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O
493735,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O,449.16419,[M+H]+,30.0,val,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O
493736,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O,449.16419,[M+H]+,20.0,val,COCCn1c(SCC(=O)N2CCCc3ccccc32)nc2c([nH]c3ccccc32)c1=O
493737,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1,429.20335,[M+H]+,20.0,val,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1
493738,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1,429.20335,[M+H]+,20.0,val,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1
493739,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1,429.20335,[M+H]+,60.0,val,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1
493740,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1,429.20335,[M+H]+,30.0,val,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1
493741,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1,429.20335,[M+H]+,20.0,val,CN(C)C(=O)/C(C#N)=C/c1ccc(-c2nc3cnc4[nH]ccc4c3n2C2CCCCC2)o1
493742,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493743,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493744,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,427.1888,[M-H]-,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493745,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,427.1888,[M-H]-,30.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493746,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493747,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493748,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493749,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,473.19428,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493750,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,473.19428,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493751,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493752,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493753,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493754,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493755,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,30.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493756,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493757,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493758,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,30.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493759,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5cc(C)c(C)cc5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493760,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,427.1888,[M-H]-,30.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493761,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,427.1888,[M-H]-,30.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493762,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,427.1888,[M-H]-,20.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493763,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,427.1888,[M-H]-,60.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493764,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,427.1888,[M-H]-,30.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493765,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,20.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493766,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,20.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493767,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,60.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493768,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,20.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493769,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,45.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493770,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,60.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493771,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,20.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493772,O=C(CCCNC(=O)c1nccnc1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1,429.20335,[M+H]+,45.0,val,O=C(CCCNC(=O)c1cnccn1)NC(Cc1ccccc1)c1nc2ccccc2[nH]1
493773,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493774,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493775,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,427.1888,[M-H]-,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493776,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,427.1888,[M-H]-,30.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493777,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,427.1888,[M-H]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493778,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493779,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493780,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493781,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493782,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493783,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493784,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493785,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,473.19428,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493786,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493787,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493788,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,429.20335,[M+H]+,60.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493789,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,429.20335,[M+H]+,30.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493790,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1,429.20335,[M+H]+,20.0,val,Cc1ccc(CNC(=O)CCc2nnc3c4cc(-c5ccc(C)c(C)c5)nn4ccn23)o1
493791,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,443.18371,[M-H]-,45.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493792,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,443.18371,[M-H]-,45.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493793,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,443.18371,[M-H]-,45.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493794,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,443.18371,[M-H]-,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493795,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,443.18371,[M-H]-,60.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493796,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,445.19826,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493797,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,445.19826,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493798,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,445.19826,[M+H]+,30.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493799,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,445.19826,[M+H]+,60.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493800,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1,445.19826,[M+H]+,20.0,val,COc1ccc(-c2cc3nc4c(c(=O)n3[nH]2)CN(C(=O)c2n[nH]c3c2CCCC3)CC4)cc1
493801,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,455.12016,[M-H]-,45.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493802,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,455.12016,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493803,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493804,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493805,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493806,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493807,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493808,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493809,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493810,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493811,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493812,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493813,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493814,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493815,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493816,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,60.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493817,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,30.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493818,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1,457.13472,[M+H]+,20.0,val,COc1ccc(S(=O)(=O)Nc2ccccc2CN(C)C/C=C/c2ccc(Cl)cc2)cc1
493819,O=C(CCn1nnc2c1ccc(-c1noc(COc3ccc(F)cc3)n1)c2)N1CCCCCC1,465.20449,[M+H]+,20.0,val,O=C(CCn1nnc2cc(-c3noc(COc4ccc(F)cc4)n3)ccc21)N1CCCCCC1
493820,O=C(CCn1nnc2c1ccc(-c1noc(COc3ccc(F)cc3)n1)c2)N1CCCCCC1,465.20449,[M+H]+,20.0,val,O=C(CCn1nnc2cc(-c3noc(COc4ccc(F)cc4)n3)ccc21)N1CCCCCC1
493821,O=C(CCn1nnc2c1ccc(-c1noc(COc3ccc(F)cc3)n1)c2)N1CCCCCC1,465.20449,[M+H]+,60.0,val,O=C(CCn1nnc2cc(-c3noc(COc4ccc(F)cc4)n3)ccc21)N1CCCCCC1
493822,O=C(CCn1nnc2c1ccc(-c1noc(COc3ccc(F)cc3)n1)c2)N1CCCCCC1,465.20449,[M+H]+,30.0,val,O=C(CCn1nnc2cc(-c3noc(COc4ccc(F)cc4)n3)ccc21)N1CCCCCC1
493823,O=C(CCn1nnc2c1ccc(-c1noc(COc3ccc(F)cc3)n1)c2)N1CCCCCC1,465.20449,[M+H]+,20.0,val,O=C(CCn1nnc2cc(-c3noc(COc4ccc(F)cc4)n3)ccc21)N1CCCCCC1
493824,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,454.13615,[M+Cl]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493825,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,454.13615,[M+Cl]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493826,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,454.13615,[M+Cl]-,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493827,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493828,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493829,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493830,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,15.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493831,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493832,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,15.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493833,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493834,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,464.16495,[M+FA]-,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493835,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,420.17402,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493836,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,420.17402,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493837,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,420.17402,[M+H]+,60.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493838,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,420.17402,[M+H]+,30.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493839,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2,420.17402,[M+H]+,20.0,val,Cc1cnc2n(c1=O)C(CC(=O)NCCC(c1ccccc1)c1ccccc1)CS2
493840,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,480.15987,[M+FA]-,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493841,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,480.15987,[M+FA]-,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493842,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,480.15987,[M+FA]-,60.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493843,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,480.15987,[M+FA]-,15.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493844,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,480.15987,[M+FA]-,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493845,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,480.15987,[M+FA]-,15.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493846,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,480.15987,[M+FA]-,60.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493847,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,480.15987,[M+FA]-,15.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493848,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493849,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493850,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,45.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493851,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,60.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493852,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493853,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,45.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493854,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,60.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493855,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,434.15439,[M-H]-,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493856,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,436.16894,[M+H]+,20.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493857,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,436.16894,[M+H]+,20.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493858,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,436.16894,[M+H]+,60.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493859,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,436.16894,[M+H]+,20.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493860,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12,436.16894,[M+H]+,60.0,val,CCN(Cc1ccccc1)C(=O)Cc1csc2nc(-c3ccc(OC)c(OC)c3)cn12
493861,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493862,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493863,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,60.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493864,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,30.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493865,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493866,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,60.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493867,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,30.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493868,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,436.16894,[M+H]+,20.0,val,Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1
493869,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493870,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493871,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,45.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493872,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,60.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493873,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493874,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,20.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493875,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,45.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493876,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21,436.16894,[M+H]+,60.0,val,COc1ccccc1CCNC(=O)C1CCCc2sc(NC(=O)c3ccccc3)nc21
493877,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493878,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493879,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,45.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493880,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,60.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493881,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493882,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,60.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493883,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,45.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493884,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,418.17723,[M-H]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493885,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,454.15391,[M+Cl]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493886,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,454.15391,[M+Cl]-,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493887,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,454.15391,[M+Cl]-,60.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493888,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493889,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493890,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,60.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493891,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,30.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493892,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493893,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,20.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493894,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,30.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493895,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3,420.19178,[M+H]+,60.0,val,Cc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(CC(=O)Nc1ccc2c(c1)OCCO2)CC3
493896,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,20.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493897,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,20.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493898,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,60.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493899,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,30.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493900,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,20.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493901,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,60.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493902,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,30.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493903,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1,420.19178,[M+H]+,20.0,val,COC(=O)c1ccccc1C(=O)N1CCCC(Cc2nc(-c3ccccc3C)no2)C1
493904,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,470.15553,[M-H]-,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493905,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,470.15553,[M-H]-,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493906,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,470.15553,[M-H]-,60.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493907,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,470.15553,[M-H]-,30.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493908,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,470.15553,[M-H]-,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493909,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,472.17008,[M+H]+,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493910,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,472.17008,[M+H]+,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493911,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,472.17008,[M+H]+,60.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493912,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,472.17008,[M+H]+,20.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493913,COCCNC(=O)c1cc2c(cc1)c(=O)n(CC(C)C)c(SCC(=O)c1ccc(F)cc1)n2,472.17008,[M+H]+,45.0,val,COCCNC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)c3ccc(F)cc3)nc2c1
493914,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1,407.17877,[M+H]+,20.0,val,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1
493915,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1,407.17877,[M+H]+,20.0,val,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1
493916,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1,407.17877,[M+H]+,45.0,val,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1
493917,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1,407.17877,[M+H]+,60.0,val,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1
493918,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1,407.17877,[M+H]+,20.0,val,O=C(N=c1scc(-c2ccc(C3CCCCC3)cc2)n1CCO)c1ccccc1
493919,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493920,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493921,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,60.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493922,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493923,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,45.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493924,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,60.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493925,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493926,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,421.15914,[M-H]-,45.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493927,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,423.17369,[M+H]+,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493928,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,423.17369,[M+H]+,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493929,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,423.17369,[M+H]+,60.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493930,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,423.17369,[M+H]+,30.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493931,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,423.17369,[M+H]+,20.0,val,CCCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
493932,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,437.17181,[M-H]-,15.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493933,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,437.17181,[M-H]-,15.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493934,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,437.17181,[M-H]-,60.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493935,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,437.17181,[M-H]-,20.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493936,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,437.17181,[M-H]-,15.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493937,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,439.18636,[M+H]+,20.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493938,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,439.18636,[M+H]+,20.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493939,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,439.18636,[M+H]+,60.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493940,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,439.18636,[M+H]+,15.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493941,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O,439.18636,[M+H]+,20.0,val,CCCCC1(COC(=O)CCC(=O)O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O
493942,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,20.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493943,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,20.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493944,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,60.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493945,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,15.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493946,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,20.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493947,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,60.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493948,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,15.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493949,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2,439.18636,[M+H]+,20.0,val,COc1cc(C/C(=C/NC(C)=O)N(CC(=O)Cc2ccccc2)C(C)=O)cc2c1OCO2
493950,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,431.20886,[M+FA]-,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493951,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,431.20886,[M+FA]-,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493952,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,431.20886,[M+FA]-,60.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493953,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,431.20886,[M+FA]-,15.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493954,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,431.20886,[M+FA]-,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493955,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493956,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493957,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,60.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493958,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493959,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,45.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493960,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,60.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493961,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,20.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493962,O=C(C1CC1c1cc2ccccc2cc1)N1CCn2c(nnc2C2CCCC2)C1,387.21794,[M+H]+,45.0,val,O=C(C1CC1c1ccc2ccccc2c1)N1CCn2c(nnc2C2CCCC2)C1
493963,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493964,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493965,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,60.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493966,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,30.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493967,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493968,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493969,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493970,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,60.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493971,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,30.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493972,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493973,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,60.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493974,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,30.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493975,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2,387.21794,[M+H]+,20.0,val,Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2
493976,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493977,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493978,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493979,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493980,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493981,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493982,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493983,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493984,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493985,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493986,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493987,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493988,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493989,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493990,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493991,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,60.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493992,CN1CCN(c2cccc(Nc3nn4cccc(-c5ccc(S(C)(=O)=O)cc5)c4n3)c2)CC1,463.19107,[M+H]+,20.0,val,CN1CCN(c2cccc(Nc3nc4c(-c5ccc(S(C)(=O)=O)cc5)cccn4n3)c2)CC1
493993,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493994,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493995,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,45.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493996,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,60.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493997,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493998,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,45.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
493999,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,60.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494000,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,537.12498,[M-H]-,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494001,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,539.13953,[M+H]+,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494002,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,539.13953,[M+H]+,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494003,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,539.13953,[M+H]+,60.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494004,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,539.13953,[M+H]+,15.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494005,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12,539.13953,[M+H]+,20.0,val,O=c1c2cc(O)ccc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)c(O)c12
494006,CC(C)=CC(=O)OC1c2c3oc(=O)ccc3ccc2OC(C)(C)C1OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,CC(C)=CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)C=C(C)C
494007,CC(C)=CC(=O)OC1c2c3oc(=O)ccc3ccc2OC(C)(C)C1OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,CC(C)=CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)C=C(C)C
494008,CC(C)=CC(=O)OC1c2c3oc(=O)ccc3ccc2OC(C)(C)C1OC(=O)C=C(C)C,444.20168,[M+NH4]+,60.0,val,CC(C)=CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)C=C(C)C
494009,CC(C)=CC(=O)OC1c2c3oc(=O)ccc3ccc2OC(C)(C)C1OC(=O)C=C(C)C,444.20168,[M+NH4]+,15.0,val,CC(C)=CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)C=C(C)C
494010,CC(C)=CC(=O)OC1c2c3oc(=O)ccc3ccc2OC(C)(C)C1OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,CC(C)=CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)C=C(C)C
494011,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494012,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494013,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,60.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494014,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,15.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494015,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494016,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,60.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494017,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,15.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494018,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,444.20168,[M+NH4]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494019,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,449.15707,[M+Na]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494020,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,449.15707,[M+Na]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494021,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,449.15707,[M+Na]+,60.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494022,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,449.15707,[M+Na]+,30.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494023,C/C=C(/C)C(=O)OC1c2c3oc(=O)ccc3ccc2OC1C(C)(C)OC(=O)C=C(C)C,449.15707,[M+Na]+,20.0,val,C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC1C(C)(C)OC(=O)C=C(C)C
494024,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,488.17579,[M+FA]-,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494025,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,488.17579,[M+FA]-,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494026,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,488.17579,[M+FA]-,60.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494027,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,488.17579,[M+FA]-,15.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494028,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,488.17579,[M+FA]-,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494029,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494030,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494031,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,60.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494032,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,30.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494033,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494034,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,60.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494035,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,30.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494036,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl,444.18486,[M+H]+,20.0,val,O=C(CN1CCc2ccccc2C1C(=O)N1CCCCC1)NCc1ccc(F)cc1Cl
494037,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,488.14163,[M+Cl]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494038,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,488.14163,[M+Cl]-,30.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494039,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,488.14163,[M+Cl]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494040,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494041,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494042,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,60.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494043,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,15.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494044,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494045,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,60.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494046,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,15.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494047,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,498.17043,[M+FA]-,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494048,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494049,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494050,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,60.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494051,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,30.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494052,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494053,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,60.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494054,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,30.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494055,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2cc3c(cc2)-c2ccccc2C3)C1,454.1795,[M+H]+,20.0,val,O=C(NCCN1CCS(=O)(=O)CC1)C1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
494056,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,572.17783,[M+Cl]-,30.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494057,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,572.17783,[M+Cl]-,30.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494058,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,572.17783,[M+Cl]-,60.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494059,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,572.17783,[M+Cl]-,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494060,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,572.17783,[M+Cl]-,30.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494061,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,582.20663,[M+FA]-,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494062,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,582.20663,[M+FA]-,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494063,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,582.20663,[M+FA]-,60.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494064,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,582.20663,[M+FA]-,15.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494065,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,582.20663,[M+FA]-,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494066,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494067,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494068,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,60.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494069,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,30.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494070,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494071,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,60.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494072,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,30.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494073,Nc1c2ncn([C@@H]3O[C@H](C(=O)N4CCN(CC(=O)Nc5cccc6c5CNC6=O)CC4)[C@@H](O)[C@H]3O)c2ncn1,538.21571,[M+H]+,20.0,val,Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O
494074,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494075,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494076,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494077,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,30.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494078,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494079,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,60.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494080,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,30.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494081,COc1c(OC)cc(C2CCCN2C(=O)Nc2c(N3CCOCC3)ccc(C(F)(F)F)c2)cc1,480.21047,[M+H]+,20.0,val,COc1ccc(C2CCCN2C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1OC
494082,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494083,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494084,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,60.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494085,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,15.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494086,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494087,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494088,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,15.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494089,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,485.19294,[M+FA]-,60.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494090,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494091,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494092,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,60.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494093,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,30.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494094,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494095,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,30.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494096,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,60.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494097,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1,441.20201,[M+H]+,20.0,val,COCCCNC(=O)C1CCC(=O)N(c2ccc3c(c2)OCO3)C1c1ccc(OC)cc1
494098,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494099,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494100,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,60.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494101,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,30.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494102,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494103,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,60.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494104,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,30.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494105,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494106,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494107,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494108,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,60.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494109,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,30.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494110,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1,433.23465,[M+H]+,20.0,val,COC(=O)c1cnc(N2CCN(c3nnc(Cc4ccccc4)c(C)c3C)C[C@H]2C)cn1
494111,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494112,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494113,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,60.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494114,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,15.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494115,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494116,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,60.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494117,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,15.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494118,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,493.20273,[M+FA]-,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494119,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494120,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494121,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,15.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494122,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,60.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494123,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494124,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,60.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494125,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1,449.21181,[M+H]+,20.0,val,O=C(Cn1ccnc1-c1ccnc(N2CCSCC2)c1)N1CCN(c2ccccc2)CC1
494126,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,505.23172,[M+FA]-,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494127,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,505.23172,[M+FA]-,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494128,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,505.23172,[M+FA]-,15.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494129,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,505.23172,[M+FA]-,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494130,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494131,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494132,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,60.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494133,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494134,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,45.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494135,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,20.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494136,Cc1nn(C(C)C)c(-c2cn3CCOc4c(ccc(-c5cn(C(C)(C)C(N)=O)nc5)c4)-c3n2)n1,461.2408,[M+H]+,45.0,val,Cc1nc(-c2cn3c(n2)-c2ccc(-c4cnn(C(C)(C)C(N)=O)c4)cc2OCC3)n(C(C)C)n1
494137,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,20.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494138,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,20.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494139,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,60.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494140,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,20.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494141,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,60.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494142,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1,461.2408,[M+H]+,20.0,val,N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
494143,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,505.17153,[M+FA]-,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494144,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,505.17153,[M+FA]-,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494145,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,505.17153,[M+FA]-,15.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494146,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,505.17153,[M+FA]-,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494147,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494148,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494149,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494150,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,15.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494151,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494152,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494153,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,15.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494154,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,461.18061,[M+H]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494155,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494156,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494157,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494158,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,15.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494159,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494160,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494161,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,15.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494162,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,478.20716,[M+NH4]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494163,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,483.16255,[M+Na]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494164,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,483.16255,[M+Na]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494165,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,483.16255,[M+Na]+,60.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494166,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,483.16255,[M+Na]+,20.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494167,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4cocc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1,483.16255,[M+Na]+,45.0,val,CC(=O)OC[C@@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)OC3=O)[C@H]1CC[C@H](OC(C)=O)[C@]21CO1
494168,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,509.15838,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494169,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,509.15838,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494170,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,509.15838,[M+FA]-,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494171,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,509.15838,[M+FA]-,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494172,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,509.15838,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494173,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,465.16746,[M+H]+,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494174,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,465.16746,[M+H]+,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494175,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,465.16746,[M+H]+,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494176,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,465.16746,[M+H]+,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494177,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,465.16746,[M+H]+,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494178,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,482.194,[M+NH4]+,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494179,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,482.194,[M+NH4]+,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494180,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,482.194,[M+NH4]+,60.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494181,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,482.194,[M+NH4]+,15.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494182,OC[C@H]1O[C@@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,482.194,[M+NH4]+,20.0,val,OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
494183,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,486.18819,[M-H]-,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494184,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,486.18819,[M-H]-,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494185,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,486.18819,[M-H]-,60.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494186,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,486.18819,[M-H]-,30.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494187,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,486.18819,[M-H]-,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494188,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494189,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494190,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,60.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494191,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,30.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494192,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494193,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,60.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494194,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,30.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494195,CON(C)Cc1c2C[C@H]3C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C3=C(O)c2c(O)cc1,488.20274,[M+H]+,20.0,val,CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
494196,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494197,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494198,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,60.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494199,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494200,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,45.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494201,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,60.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494202,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494203,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,409.21328,[M-H]-,45.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494204,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,455.21876,[M+FA]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494205,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,455.21876,[M+FA]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494206,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,455.21876,[M+FA]-,60.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494207,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,455.21876,[M+FA]-,15.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494208,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,455.21876,[M+FA]-,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494209,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494210,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494211,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,30.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494212,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,60.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494213,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,15.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494214,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494215,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,60.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494216,CCOc1ccc(C2(CNC(=O)NC3CCc4c3cccc4O)CCOCC2)cc1,411.22783,[M+H]+,20.0,val,CCOc1ccc(C2(CNC(=O)NC3CCc4c(O)cccc43)CCOCC2)cc1
494217,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494218,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494219,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494220,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,15.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494221,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494222,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494223,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494224,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,409.21328,[M-H]-,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494225,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,409.21328,[M-H]-,30.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494226,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494227,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494228,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494229,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,455.21876,[M+FA]-,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494230,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,455.21876,[M+FA]-,15.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494231,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494232,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494233,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494234,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,60.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494235,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,15.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494236,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,409.21328,[M-H]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494237,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494238,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494239,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,455.21876,[M+FA]-,60.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494240,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,455.21876,[M+FA]-,15.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494241,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,455.21876,[M+FA]-,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494242,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494243,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494244,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,411.22783,[M+H]+,60.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494245,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,411.22783,[M+H]+,15.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494246,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C)cc1
494247,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494248,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494249,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494250,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,30.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494251,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494252,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,60.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494253,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,30.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494254,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1
494255,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494256,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494257,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,60.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494258,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,15.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494259,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494260,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,60.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494261,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,15.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494262,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,411.22783,[M+H]+,20.0,val,COC(=O)CCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
494263,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,455.21876,[M+FA]-,20.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494264,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,455.21876,[M+FA]-,60.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494265,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,455.21876,[M+FA]-,15.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494266,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,455.21876,[M+FA]-,20.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494267,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,20.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494268,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,20.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494269,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,30.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494270,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,60.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494271,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,20.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494272,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,45.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494273,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,60.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494274,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1,411.22783,[M+H]+,20.0,val,CC1(C)Cc2cccc(OCc3ccc(C(=O)NCCN4CCOCC4)cc3)c2O1
494275,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494276,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494277,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,30.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494278,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494279,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,15.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494280,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494281,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,60.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494282,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1,411.22783,[M+H]+,20.0,val,COc1ccc(C(=O)N2CCCC2COc2ccc(C(=O)NC(C)C)cc2)c(C)c1
494283,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,411.22783,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494284,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,411.22783,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494285,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,411.22783,[M+H]+,60.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494286,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,411.22783,[M+H]+,15.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494287,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1,411.22783,[M+H]+,20.0,val,CCCCOc1ccc(C(=O)NCC2CCN(C(=O)Oc3ccccc3)CC2)cc1
494288,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12,367.22677,[M+H]+,20.0,val,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
494289,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12,367.22677,[M+H]+,20.0,val,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
494290,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12,367.22677,[M+H]+,60.0,val,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
494291,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12,367.22677,[M+H]+,30.0,val,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
494292,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12,367.22677,[M+H]+,20.0,val,C[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
494293,CC(C)=CCC/C(C)=C/COc1c(CC=C(C)C)c2c(cc1)ccc(=O)o2,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1CC=C(C)C
494294,CC(C)=CCC/C(C)=C/COc1c(CC=C(C)C)c2c(cc1)ccc(=O)o2,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1CC=C(C)C
494295,CC(C)=CCC/C(C)=C/COc1c(CC=C(C)C)c2c(cc1)ccc(=O)o2,367.22677,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1CC=C(C)C
494296,CC(C)=CCC/C(C)=C/COc1c(CC=C(C)C)c2c(cc1)ccc(=O)o2,367.22677,[M+H]+,15.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1CC=C(C)C
494297,CC(C)=CCC/C(C)=C/COc1c(CC=C(C)C)c2c(cc1)ccc(=O)o2,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1CC=C(C)C
494298,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1
494299,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1
494300,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1,367.22677,[M+H]+,60.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1
494301,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1,367.22677,[M+H]+,15.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1
494302,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1,367.22677,[M+H]+,20.0,val,CC(C)=CCC/C(C)=C/CC/C(C)=C/COc1ccc2ccc(=O)oc2c1
494303,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,461.19158,[M-H]-,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494304,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,461.19158,[M-H]-,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494305,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,461.19158,[M-H]-,60.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494306,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,461.19158,[M-H]-,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494307,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,461.19158,[M-H]-,60.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494308,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494309,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494310,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,60.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494311,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,30.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494312,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494313,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,60.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494314,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,30.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494315,O=C(NS(=O)(=O)N1CCC1)c1c(F)cc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1,463.20613,[M+H]+,20.0,val,O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F
494316,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,471.22491,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494317,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,471.22491,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494318,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,471.22491,[M-H]-,60.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494319,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,471.22491,[M-H]-,30.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494320,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,471.22491,[M-H]-,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494321,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494322,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494323,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,60.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494324,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,15.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494325,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494326,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,60.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494327,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,15.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494328,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1,473.23946,[M+H]+,20.0,val,CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)NCC(=O)O)CC1
494329,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494330,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494331,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,60.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494332,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494333,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,45.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494334,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,60.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494335,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494336,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,419.25648,[M-H]-,45.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494337,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,455.23316,[M+Cl]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494338,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,455.23316,[M+Cl]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494339,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,455.23316,[M+Cl]-,60.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494340,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,465.26196,[M+FA]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494341,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,465.26196,[M+FA]-,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494342,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,465.26196,[M+FA]-,60.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494343,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,465.26196,[M+FA]-,30.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494344,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,421.27104,[M+H]+,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494345,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,421.27104,[M+H]+,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494346,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,421.27104,[M+H]+,60.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494347,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,421.27104,[M+H]+,30.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494348,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2,421.27104,[M+H]+,20.0,val,CC(C)(C)NC1=Nc2ccccc2CNC12CCN(C(=O)c1n[nH]c3c1CCCC3)C2
494349,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,20.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494350,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,20.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494351,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,60.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494352,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,30.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494353,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,20.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494354,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,60.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494355,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,30.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494356,COCCNC1CCC(Nc2ncc(Cl)c(-c3csc(NCC4(C#N)CCOCC4)n3)c2)CC1,505.2147,[M+H]+,20.0,val,COCCNC1CCC(Nc2cc(-c3csc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1
494357,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494358,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494359,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494360,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494361,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494362,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494363,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494364,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,479.22866,[M+FA]-,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494365,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,399.21661,[M+H-2H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494366,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,399.21661,[M+H-2H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494367,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,399.21661,[M+H-2H2O]+,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494368,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,399.21661,[M+H-2H2O]+,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494369,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,399.21661,[M+H-2H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494370,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,417.22717,[M+H-H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494371,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,417.22717,[M+H-H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494372,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,417.22717,[M+H-H2O]+,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494373,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,417.22717,[M+H-H2O]+,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494374,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,417.22717,[M+H-H2O]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494375,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494376,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494377,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494378,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494379,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494380,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,60.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494381,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,15.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494382,COc1c(C)c(=O)oc(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)c1C,435.23773,[M+H]+,20.0,val,COc1c(C)c(C(C)(O)C(O)/C(C)=C/C(C)=C/C2(C)OC(C)C3(C)OC23)oc(=O)c1C
494383,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,20.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494384,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,20.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494385,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,60.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494386,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,30.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494387,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,20.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494388,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,30.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494389,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,60.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494390,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1,398.2802,[M+H]+,20.0,val,O=C(CC1CCCCC1)N1CCCN(C2CCN(Cc3ccccc3)C2=O)CC1
494391,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494392,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494393,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494394,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,15.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494395,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494396,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494397,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,476.24339,[M-H]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494398,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494399,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494400,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494401,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,15.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494402,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494403,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494404,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,15.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494405,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,522.24887,[M+FA]-,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494406,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494407,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494408,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494409,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,15.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494410,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494411,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,60.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494412,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,15.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494413,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1,478.25794,[M+H]+,20.0,val,CCC(CC)C(=O)N1CCC(NC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)CC1
494414,OC[C@H]1O[C@@H](O[C@H]2[C@H](OCc3ccccc3)O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,609.20362,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](O[C@H]2[C@H](OCc3ccccc3)O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
494415,OC[C@H]1O[C@@H](O[C@H]2[C@H](OCc3ccccc3)O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,609.20362,[M+FA]-,20.0,val,OC[C@H]1O[C@@H](O[C@H]2[C@H](OCc3ccccc3)O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
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494466,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,425.28977,[M+H-H2O]+,15.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494467,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,425.28977,[M+H-H2O]+,15.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494468,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,425.28977,[M+H-H2O]+,20.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494469,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,425.28977,[M+H-H2O]+,60.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494470,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,425.28977,[M+H-H2O]+,15.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494471,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,460.32688,[M+NH4]+,20.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494472,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,460.32688,[M+NH4]+,20.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494473,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,460.32688,[M+NH4]+,60.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494474,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,460.32688,[M+NH4]+,15.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494475,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O,460.32688,[M+NH4]+,20.0,val,CC(CCOC(=O)CCC(=O)O)CCC1(C)C(C)CCC2(C)C1CC(O)C(O)C2(C)O
494476,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,574.07059,[M+FA]-,20.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494477,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,574.07059,[M+FA]-,15.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494478,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494479,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494480,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494481,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494482,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,60.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494483,CS(=O)(=O)c1cnc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)cc1,530.07966,[M+H]+,20.0,val,CS(=O)(=O)c1ccc(-c2nnc(/C=C/c3nnc(-c4ccc(C#N)cc4)o3)n2-c2ccccc2Cl)nc1
494484,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,20.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494485,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,20.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494486,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,60.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494487,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,20.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494488,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,60.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494489,O=c1c2c(ccc([N+](=O)[O-])c2)oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12,487.06055,[M-H]-,20.0,val,O=c1c2cc([N+](=O)[O-])ccc2oc2cc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc(O)c12
494490,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,455.09164,[M-H]-,20.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494491,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,455.09164,[M-H]-,20.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494492,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,455.09164,[M-H]-,60.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494493,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,455.09164,[M-H]-,20.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494494,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,455.09164,[M-H]-,60.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494495,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,457.10619,[M+H]+,20.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494496,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,457.10619,[M+H]+,20.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494497,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,457.10619,[M+H]+,60.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494498,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12,457.10619,[M+H]+,45.0,val,O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2c(-c3ccc(Cl)cc3)c(Cc3ccccc3)[nH]n12
494499,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,504.09474,[M-H]-,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494500,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,504.09474,[M-H]-,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494501,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,504.09474,[M-H]-,60.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494502,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,504.09474,[M-H]-,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494503,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,504.09474,[M-H]-,45.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494504,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,506.10929,[M+H]+,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494505,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,506.10929,[M+H]+,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494506,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,506.10929,[M+H]+,60.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494507,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,506.10929,[M+H]+,20.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494508,COc1c(NS(=O)(=O)c2c(F)cc(F)cc2)cc(-c2cc3c(-c4cnncc4)ccnc3cc2)cn1,506.10929,[M+H]+,45.0,val,COc1ncc(-c2ccc3nccc(-c4ccnnc4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
494509,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494510,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494511,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,60.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494512,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494513,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,60.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494514,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,477.118,[M-H]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494515,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,513.09468,[M+Cl]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494516,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,513.09468,[M+Cl]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494517,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,513.09468,[M+Cl]-,60.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494518,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,513.09468,[M+Cl]-,15.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494519,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,513.09468,[M+Cl]-,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494520,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494521,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494522,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,60.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494523,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,30.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494524,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494525,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,60.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494526,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,30.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494527,O=C1CCc2c(Oc3cc4c(cc3)O[C@@H]3[C@@H](c5nc6c(cc(C(F)(F)F)cc6)[nH]5)[C@H]43)ccnc2N1,479.13255,[M+H]+,20.0,val,O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3[C@H](O4)[C@H]3c3nc4ccc(C(F)(F)F)cc4[nH]3)ccnc2N1
494528,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,533.02434,[M-H]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494529,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,533.02434,[M-H]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494530,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,533.02434,[M-H]-,60.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494531,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,533.02434,[M-H]-,30.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494532,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,533.02434,[M-H]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494533,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,569.00102,[M+Cl]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494534,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,569.00102,[M+Cl]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494535,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,569.00102,[M+Cl]-,60.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494536,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,569.00102,[M+Cl]-,15.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494537,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,569.00102,[M+Cl]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494538,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,579.02982,[M+FA]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494539,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,579.02982,[M+FA]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494540,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,579.02982,[M+FA]-,60.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494541,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,579.02982,[M+FA]-,15.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494542,Cc1cn(C(=O)c2c(C(C)(C)F)onc2-c2c(Cl)cc(Cl)cc2Cl)c2cccc(/C=C/C(=O)O)c12,579.02982,[M+FA]-,20.0,val,Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C(C)(C)F)c2cccc(/C=C/C(=O)O)c12
494543,N#Cc1c(-c2ccc(OCCO)cc2)c(C#N)c(SCc2csc(-c3ccc(Cl)cc3)n2)nc1N,518.05177,[M-H]-,20.0,val,N#Cc1c(N)nc(SCc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OCCO)cc1
494544,N#Cc1c(-c2ccc(OCCO)cc2)c(C#N)c(SCc2csc(-c3ccc(Cl)cc3)n2)nc1N,518.05177,[M-H]-,20.0,val,N#Cc1c(N)nc(SCc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OCCO)cc1
494545,N#Cc1c(-c2ccc(OCCO)cc2)c(C#N)c(SCc2csc(-c3ccc(Cl)cc3)n2)nc1N,518.05177,[M-H]-,60.0,val,N#Cc1c(N)nc(SCc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OCCO)cc1
494546,N#Cc1c(-c2ccc(OCCO)cc2)c(C#N)c(SCc2csc(-c3ccc(Cl)cc3)n2)nc1N,518.05177,[M-H]-,30.0,val,N#Cc1c(N)nc(SCc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OCCO)cc1
494547,N#Cc1c(-c2ccc(OCCO)cc2)c(C#N)c(SCc2csc(-c3ccc(Cl)cc3)n2)nc1N,518.05177,[M-H]-,20.0,val,N#Cc1c(N)nc(SCc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1-c1ccc(OCCO)cc1
494548,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494549,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494550,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,60.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494551,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,30.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494552,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494553,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,60.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494554,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,30.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494555,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,516.06768,[M-H]-,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494556,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,518.08223,[M+H]+,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494557,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,518.08223,[M+H]+,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494558,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,518.08223,[M+H]+,60.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494559,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,518.08223,[M+H]+,30.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494560,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cc(Br)ccc1,518.08223,[M+H]+,20.0,val,C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1cccc(Br)c1
494561,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O,447.16271,[M+H]+,45.0,val,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O
494562,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O,447.16271,[M+H]+,45.0,val,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O
494563,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O,447.16271,[M+H]+,45.0,val,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O
494564,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O,447.16271,[M+H]+,20.0,val,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O
494565,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O,447.16271,[M+H]+,60.0,val,O=C(NCc1ccc(F)cc1F)c1ccc2c(c1)nc1n2CCN(Cc2ccccc2)C1=O
494566,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494567,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494568,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,60.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494569,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,30.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494570,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494571,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494572,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494573,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,60.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494574,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,30.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494575,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,426.14593,[M-H]-,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494576,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494577,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494578,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494579,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494580,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,45.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494581,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494582,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494583,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,426.14593,[M-H]-,45.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494584,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494585,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494586,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,60.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494587,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,15.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494588,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494589,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,60.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494590,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,15.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494591,O=C(Cn1nc(-c2cc3ccccc3cc2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2ccc3ccccc3c2)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494592,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494593,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494594,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,60.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494595,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,15.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494596,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O,428.16048,[M+H]+,20.0,val,O=C(Cn1nc(-c2cccc3ccccc23)ccc1=O)N[C@@H](Cc1ccccc1)C(=O)O
494597,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494598,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494599,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494600,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,30.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494601,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494602,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494603,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,30.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494604,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCO,428.16048,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCO
494605,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,466.16331,[M-H]-,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494606,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,466.16331,[M-H]-,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494607,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,466.16331,[M-H]-,60.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494608,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,466.16331,[M-H]-,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494609,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,466.16331,[M-H]-,45.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494610,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,512.16879,[M+FA]-,15.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494611,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,512.16879,[M+FA]-,15.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494612,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,512.16879,[M+FA]-,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494613,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,512.16879,[M+FA]-,60.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494614,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,512.16879,[M+FA]-,15.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494615,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,468.17786,[M+H]+,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494616,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,468.17786,[M+H]+,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494617,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,468.17786,[M+H]+,60.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494618,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,468.17786,[M+H]+,20.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494619,Nc1ncc(C(=O)Nc2cccc(-c3nc4c(oc5c4cccn5)c(N4CCOCC4)n3)c2)cc1,468.17786,[M+H]+,60.0,val,Nc1ccc(C(=O)Nc2cccc(-c3nc(N4CCOCC4)c4oc5ncccc5c4n3)c2)cn1
494620,O=C(O)[C@@H](Cc1ccccc1)NCc1c2oc(=O)cc(-c3ccccc3)c2ccc1O,416.14925,[M+H]+,20.0,val,O=C(O)[C@@H](Cc1ccccc1)NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12
494621,O=C(O)[C@@H](Cc1ccccc1)NCc1c2oc(=O)cc(-c3ccccc3)c2ccc1O,416.14925,[M+H]+,20.0,val,O=C(O)[C@@H](Cc1ccccc1)NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12
494622,O=C(O)[C@@H](Cc1ccccc1)NCc1c2oc(=O)cc(-c3ccccc3)c2ccc1O,416.14925,[M+H]+,30.0,val,O=C(O)[C@@H](Cc1ccccc1)NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12
494623,O=C(O)[C@@H](Cc1ccccc1)NCc1c2oc(=O)cc(-c3ccccc3)c2ccc1O,416.14925,[M+H]+,20.0,val,O=C(O)[C@@H](Cc1ccccc1)NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12
494624,O=C(O)[C@@H](Cc1ccccc1)NCc1c2oc(=O)cc(-c3ccccc3)c2ccc1O,416.14925,[M+H]+,20.0,val,O=C(O)[C@@H](Cc1ccccc1)NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12
494625,CN1CCN(c2nc3c(cccc3F)c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1,449.17836,[M+H]+,20.0,val,CN1CCN(c2nc3c(F)cccc3c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1
494626,CN1CCN(c2nc3c(cccc3F)c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1,449.17836,[M+H]+,20.0,val,CN1CCN(c2nc3c(F)cccc3c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1
494627,CN1CCN(c2nc3c(cccc3F)c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1,449.17836,[M+H]+,60.0,val,CN1CCN(c2nc3c(F)cccc3c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1
494628,CN1CCN(c2nc3c(cccc3F)c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1,449.17836,[M+H]+,30.0,val,CN1CCN(c2nc3c(F)cccc3c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1
494629,CN1CCN(c2nc3c(cccc3F)c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1,449.17836,[M+H]+,20.0,val,CN1CCN(c2nc3c(F)cccc3c(=O)n2-c2ccc(Oc3ccc(F)cc3)cc2)CC1
494630,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494631,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494632,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,60.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494633,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,30.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494634,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494635,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,60.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494636,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,30.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494637,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,478.12423,[M-H]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494638,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,514.10091,[M+Cl]-,15.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494639,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,514.10091,[M+Cl]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494640,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,514.10091,[M+Cl]-,60.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494641,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,524.12971,[M+FA]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494642,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,524.12971,[M+FA]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494643,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,524.12971,[M+FA]-,60.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494644,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,524.12971,[M+FA]-,15.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494645,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,524.12971,[M+FA]-,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494646,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,480.13878,[M+H]+,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494647,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,480.13878,[M+H]+,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494648,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,480.13878,[M+H]+,60.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494649,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,480.13878,[M+H]+,30.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494650,CC1Cc2ccccc2N1S(=O)(=O)c1cc(C(=O)Nc2cc3c(cc2)NC(=O)CC3)c(F)cc1,480.13878,[M+H]+,20.0,val,CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1
494651,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,20.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494652,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,20.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494653,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,60.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494654,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,20.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494655,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,45.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494656,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,60.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494657,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,20.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494658,O=C1Cc2c(ccc(-c3c4ccnc(N5CCC(O)CC5)n4nc3-c3ccc(F)cc3)c2)N1,444.18303,[M+H]+,45.0,val,O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nn4c(N5CCC(O)CC5)nccc34)ccc2N1
494659,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,418.14601,[M-H]-,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494660,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,418.14601,[M-H]-,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494661,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,418.14601,[M-H]-,60.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494662,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,418.14601,[M-H]-,30.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494663,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,418.14601,[M-H]-,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494664,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,420.16056,[M+H]+,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494665,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,420.16056,[M+H]+,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494666,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,420.16056,[M+H]+,60.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494667,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,420.16056,[M+H]+,30.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494668,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1,420.16056,[M+H]+,20.0,val,O=C(O)c1ccc(CN(CC2CC2)C(=O)c2ccc(Oc3ccccc3F)cc2)cc1
494669,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494670,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494671,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,60.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494672,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,15.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494673,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494674,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,15.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494675,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494676,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,418.14601,[M-H]-,60.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494677,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,420.16056,[M+H]+,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494678,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,420.16056,[M+H]+,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494679,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,420.16056,[M+H]+,60.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494680,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,420.16056,[M+H]+,15.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494681,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O,420.16056,[M+H]+,20.0,val,C[C@@](Cc1ccccc1F)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
494682,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,20.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494683,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,20.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494684,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,60.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494685,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,20.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494686,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,75.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494687,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,60.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494688,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,20.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494689,CN(C)c1cc2c(cc1)C1(OC(=O)c3c1ccc(C(=O)O)c3)c1c(cc(N(C)C)cc1)O2,431.16015,[M+H]+,75.0,val,CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)O)ccc21
494690,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494691,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494692,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494693,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494694,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494695,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494696,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494697,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494698,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494699,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494700,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494701,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494702,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494703,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494704,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494705,COc1c(O)ccc(C2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3OC2CO)ccc1O
494706,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494707,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494708,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494709,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494710,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494711,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494712,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494713,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494714,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494715,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494716,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,517.0907,[M+Cl]-,60.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494717,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,517.0907,[M+Cl]-,15.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494718,COc1c(O)ccc([C@@H]2Oc3c(cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O)[C@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O
494719,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494720,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494721,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494722,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494723,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494724,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494725,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494726,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494727,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494728,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494729,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,517.0907,[M+Cl]-,60.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494730,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,517.0907,[M+Cl]-,15.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494731,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494732,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494733,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494734,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494735,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494736,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494737,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494738,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494739,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494740,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494741,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494742,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,517.0907,[M+Cl]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494743,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,517.0907,[M+Cl]-,15.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494744,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,517.0907,[M+Cl]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494745,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,483.12857,[M+H]+,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494746,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,483.12857,[M+H]+,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494747,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,483.12857,[M+H]+,60.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494748,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,483.12857,[M+H]+,15.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494749,COc1c(O)ccc(C2Oc3c(ccc(C4Oc5cc(O)cc(O)c5C(=O)C4O)c3)OC2CO)c1,483.12857,[M+H]+,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494750,COc1c(O)ccc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)ccc1O
494751,COc1c(O)ccc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)ccc1O
494752,COc1c(O)ccc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)c1,481.11402,[M-H]-,60.0,val,COc1cc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)ccc1O
494753,COc1c(O)ccc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)c1,481.11402,[M-H]-,30.0,val,COc1cc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)ccc1O
494754,COc1c(O)ccc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)c1,481.11402,[M-H]-,20.0,val,COc1cc(C2C3C=C(C4Oc5cc(O)cc(O)c5C(=O)C4O)C4C2COC4(O)C3=O)ccc1O
494755,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494756,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494757,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494758,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494759,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494760,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494761,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494762,COc1c(O)ccc([C@H]2Oc3c(ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)c3)O[C@@H]2CO)c1,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@@H]2CO)ccc1O
494763,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494764,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494765,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494766,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494767,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494768,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494769,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494770,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@@H]2CO)ccc1O
494771,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494772,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494773,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494774,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494775,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2CO)ccc1O
494776,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494777,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494778,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494779,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494780,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494781,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,45.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494782,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494783,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O
494784,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494785,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494786,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,45.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494787,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494788,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494789,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,45.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494790,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494791,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O
494792,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494793,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494794,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494795,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494796,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494797,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,60.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494798,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,30.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494799,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,481.11402,[M-H]-,20.0,val,COc1cc([C@@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O
494800,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494801,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494802,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494803,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,30.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494804,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494805,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494806,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,30.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494807,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,477.15797,[M-H]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494808,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494809,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494810,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494811,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,15.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494812,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494813,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494814,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494815,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,513.13465,[M+Cl]-,15.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494816,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494817,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494818,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494819,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,15.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494820,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494821,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494822,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494823,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,523.16345,[M+FA]-,15.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494824,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494825,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494826,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494827,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,30.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494828,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494829,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,60.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494830,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,30.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494831,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC,479.17252,[M+H]+,20.0,val,COc1ccc(CCn2c(=O)c3ncccc3n(CC(=O)Nc3ccc(F)cc3)c2=O)cc1OC
494832,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,20.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494833,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,20.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494834,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,60.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494835,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,45.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494836,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,60.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494837,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,549.09053,[M-H]-,45.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494838,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,551.10508,[M+H]+,20.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494839,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,551.10508,[M+H]+,20.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494840,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,551.10508,[M+H]+,60.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494841,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,551.10508,[M+H]+,20.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494842,CN1CCN(c2cc3c(cc2)nc(-c2cc4c(cc2)nc(-c2cc(I)c(O)cc2)[nH]4)[nH]3)CC1,551.10508,[M+H]+,60.0,val,CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)c(I)c6)[nH]c5c4)[nH]c3c2)CC1
494843,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1,478.14312,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1
494844,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1,478.14312,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1
494845,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1,478.14312,[M+H]+,60.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1
494846,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1,478.14312,[M+H]+,15.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1
494847,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1,478.14312,[M+H]+,20.0,val,COC(=O)c1ccccc1NC(=O)CSc1nc2c(oc3ccccc32)c(=O)n1C1CCCC1
494848,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O,402.16998,[M+H]+,20.0,val,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O
494849,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O,402.16998,[M+H]+,20.0,val,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O
494850,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O,402.16998,[M+H]+,60.0,val,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O
494851,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O,402.16998,[M+H]+,15.0,val,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O
494852,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O,402.16998,[M+H]+,20.0,val,CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O
494853,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1,494.10738,[M+H]+,20.0,val,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1
494854,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1,494.10738,[M+H]+,20.0,val,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1
494855,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1,494.10738,[M+H]+,60.0,val,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1
494856,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1,494.10738,[M+H]+,30.0,val,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1
494857,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1,494.10738,[M+H]+,20.0,val,COc1ccc(CC(=O)Nc2ccc(/C(C)=N/NC(=O)Cc3ccc(Br)cc3)cc2)cc1
494858,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,20.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494859,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,20.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494860,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,60.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494861,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,30.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494862,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,20.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494863,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,60.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494864,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,30.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494865,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1,386.2027,[M+H]+,20.0,val,C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1
494866,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494867,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494868,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494869,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,15.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494870,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494871,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494872,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494873,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494874,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494875,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,45.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494876,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494877,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494878,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494879,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,30.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494880,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494881,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494882,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,30.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494883,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,420.16166,[M-H]-,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494884,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494885,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494886,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494887,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494888,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,45.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494889,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,60.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494890,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,20.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494891,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)c2ccccc2nc1C1CC1,422.17621,[M+H]+,45.0,val,O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
494892,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,20.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494893,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,20.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494894,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,60.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494895,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,20.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494896,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,45.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494897,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,60.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494898,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,20.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494899,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3cc4c(cc3)occ4)cc2)C1,429.19212,[M+H]+,45.0,val,O=C(C1CC1)N1CC[C@@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4occc4c3)cc2)C1
494900,N#Cc1c(N2CCN(Cc3cc4c(cc3)OCO4)CC2)oc(C2CC2c2ccccc2)n1,429.19212,[M+H]+,20.0,val,N#Cc1nc(C2CC2c2ccccc2)oc1N1CCN(Cc2ccc3c(c2)OCO3)CC1
494901,N#Cc1c(N2CCN(Cc3cc4c(cc3)OCO4)CC2)oc(C2CC2c2ccccc2)n1,429.19212,[M+H]+,20.0,val,N#Cc1nc(C2CC2c2ccccc2)oc1N1CCN(Cc2ccc3c(c2)OCO3)CC1
494902,N#Cc1c(N2CCN(Cc3cc4c(cc3)OCO4)CC2)oc(C2CC2c2ccccc2)n1,429.19212,[M+H]+,60.0,val,N#Cc1nc(C2CC2c2ccccc2)oc1N1CCN(Cc2ccc3c(c2)OCO3)CC1
494903,N#Cc1c(N2CCN(Cc3cc4c(cc3)OCO4)CC2)oc(C2CC2c2ccccc2)n1,429.19212,[M+H]+,15.0,val,N#Cc1nc(C2CC2c2ccccc2)oc1N1CCN(Cc2ccc3c(c2)OCO3)CC1
494904,N#Cc1c(N2CCN(Cc3cc4c(cc3)OCO4)CC2)oc(C2CC2c2ccccc2)n1,429.19212,[M+H]+,20.0,val,N#Cc1nc(C2CC2c2ccccc2)oc1N1CCN(Cc2ccc3c(c2)OCO3)CC1
494905,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,519.11496,[M-H]-,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494906,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,519.11496,[M-H]-,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494907,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,519.11496,[M-H]-,60.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494908,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,519.11496,[M-H]-,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494909,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,519.11496,[M-H]-,60.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494910,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,521.12951,[M+H]+,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494911,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,521.12951,[M+H]+,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494912,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,521.12951,[M+H]+,60.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494913,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,521.12951,[M+H]+,20.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494914,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1,521.12951,[M+H]+,45.0,val,CN1CCC(Nc2nc(Nc3ccc(Oc4ccccc4)cc3)c3c(=O)[nH]cc(Br)c3n2)CC1
494915,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494916,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494917,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,60.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494918,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494919,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,45.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494920,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,60.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494921,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494922,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,539.12738,[M-H]-,45.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494923,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494924,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494925,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,60.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494926,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,30.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494927,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494928,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,60.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494929,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,30.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494930,COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c(Cl)cc1,541.14193,[M+H]+,20.0,val,COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
494931,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,478.16514,[M-H]-,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494932,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,478.16514,[M-H]-,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494933,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,478.16514,[M-H]-,60.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494934,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,478.16514,[M-H]-,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494935,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,478.16514,[M-H]-,45.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494936,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,480.17969,[M+H]+,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494937,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,480.17969,[M+H]+,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494938,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,480.17969,[M+H]+,60.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494939,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,480.17969,[M+H]+,20.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494940,Cc1c2nc(-c3c(NC[C@@H](O)c4cc(Cl)ccc4)cc[nH]c3=O)[nH]c2cc(N2CCOCC2)c1,480.17969,[M+H]+,45.0,val,Cc1cc(N2CCOCC2)cc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12
494941,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1,431.19763,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1
494942,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1,431.19763,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1
494943,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1,431.19763,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1
494944,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1,431.19763,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1
494945,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1,431.19763,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)C(Cc2ccccc2)NC(=O)c2ccc(C)cc2)cc1
494946,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,20.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494947,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,20.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494948,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,30.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494949,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,60.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494950,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,20.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494951,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,45.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494952,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,60.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494953,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1,387.2067,[M+H]+,20.0,val,CCC(CC)(C1=N[C@H]2c3ccccc3C[C@H]2O1)C1=N[C@H]2c3ccccc3C[C@H]2O1
494954,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,481.14388,[M-H]-,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494955,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,481.14388,[M-H]-,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494956,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,481.14388,[M-H]-,60.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494957,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,481.14388,[M-H]-,30.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494958,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,481.14388,[M-H]-,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494959,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494960,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494961,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,60.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494962,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,30.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494963,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494964,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,60.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494965,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,30.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494966,CCOc1c(Cc2c(O)nc(SCc3c(OC)ccc(C(C)=O)c3)[nH]c2=O)cc(C(C)=O)cc1,483.15843,[M+H]+,20.0,val,CCOc1ccc(C(C)=O)cc1Cc1c(O)nc(SCc2cc(C(C)=O)ccc2OC)[nH]c1=O
494967,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494968,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494969,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,60.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494970,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494971,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,45.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494972,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,60.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494973,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494974,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,465.16672,[M-H]-,45.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494975,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494976,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494977,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,60.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494978,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,15.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494979,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494980,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,60.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494981,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,15.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494982,COc1c(OCCC(C)C)ccc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2noc(C)c2)c1,467.18128,[M+H]+,20.0,val,COc1cc(C2C(C(=O)c3ccco3)=C(O)C(=O)N2c2cc(C)on2)ccc1OCCC(C)C
494983,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,425.20953,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494984,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,425.20953,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494985,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,425.20953,[M-H]-,60.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494986,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,425.20953,[M-H]-,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494987,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,425.20953,[M-H]-,45.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494988,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,427.22409,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494989,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,427.22409,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494990,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,427.22409,[M+H]+,60.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494991,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,427.22409,[M+H]+,20.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494992,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1,427.22409,[M+H]+,45.0,val,Cc1c(C(=O)Nc2ccc(CN)cc2)ncnc1N1CCC(C#N)(c2ccccc2)CC1
494993,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1,427.22409,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1
494994,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1,427.22409,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1
494995,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1,427.22409,[M+H]+,15.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1
494996,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1,427.22409,[M+H]+,60.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1
494997,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1,427.22409,[M+H]+,20.0,val,Cc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3cccc4ccccc34)CC2)cc1
494998,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
494999,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495000,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495001,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495002,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495003,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495004,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495005,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495006,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495007,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495008,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495009,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495010,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495011,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495012,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495013,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495014,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495015,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495016,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495017,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495018,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495019,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,60.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495020,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,20.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495021,OC(CN1CCN(c2cc(Cl)ccc2)CC1)C(c1ccccc1)c1ccccc1,407.18847,[M+H]+,45.0,val,OC(CN1CCN(c2cccc(Cl)c2)CC1)C(c1ccccc1)c1ccccc1
495022,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,20.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495023,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,20.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495024,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,60.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495025,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,20.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495026,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,45.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495027,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,60.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495028,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,20.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495029,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1c2ccc(C(F)(F)F)cc2ncc1,509.17164,[M+H]+,45.0,val,O=c1cc(CN2CCOCC2)occ1OCCCCCSc1ccnc2cc(C(F)(F)F)ccc12
495030,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,524.16365,[M-H]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495031,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,524.16365,[M-H]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495032,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,524.16365,[M-H]-,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495033,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,524.16365,[M-H]-,15.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495034,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,524.16365,[M-H]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495035,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,560.14033,[M+Cl]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495036,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,560.14033,[M+Cl]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495037,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,560.14033,[M+Cl]-,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495038,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,560.14033,[M+Cl]-,30.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495039,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,560.14033,[M+Cl]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495040,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495041,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495042,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495043,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,15.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495044,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495045,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495046,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,15.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495047,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,570.16913,[M+FA]-,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495048,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495049,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495050,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,15.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495051,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495052,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,30.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495053,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495054,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,60.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495055,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,526.1782,[M+H]+,20.0,val,CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1
495056,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,400.20305,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495057,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,400.20305,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495058,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,400.20305,[M-H]-,60.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495059,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,400.20305,[M-H]-,30.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495060,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,400.20305,[M-H]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495061,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,436.17973,[M+Cl]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495062,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,436.17973,[M+Cl]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495063,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,436.17973,[M+Cl]-,60.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495064,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,436.17973,[M+Cl]-,15.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495065,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,436.17973,[M+Cl]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495066,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,446.20853,[M+FA]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495067,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,446.20853,[M+FA]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495068,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,446.20853,[M+FA]-,60.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495069,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,446.20853,[M+FA]-,15.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495070,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,446.20853,[M+FA]-,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495071,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,402.2176,[M+H]+,30.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495072,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,402.2176,[M+H]+,30.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495073,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,402.2176,[M+H]+,20.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495074,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,402.2176,[M+H]+,60.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495075,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21,402.2176,[M+H]+,30.0,val,Cc1nc2ccccc2cc1C(=O)NC1CC2(CCN(C)CC2)Oc2ccccc21
495076,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,400.20305,[M-H]-,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495077,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,400.20305,[M-H]-,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495078,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,400.20305,[M-H]-,60.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495079,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,400.20305,[M-H]-,30.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495080,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,400.20305,[M-H]-,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495081,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495082,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495083,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,60.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495084,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,30.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495085,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495086,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,60.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495087,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,30.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495088,CC(C)CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1Cc2ccccc2C1=O,402.2176,[M+H]+,20.0,val,CC(C)CC(C(=O)N1CCc2[nH]c3ccccc3c2C1)N1Cc2ccccc2C1=O
495089,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495090,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495091,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,60.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495092,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,30.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495093,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495094,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,60.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495095,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,30.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495096,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,460.19903,[M-H]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495097,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495098,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495099,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,60.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495100,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,15.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495101,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495102,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,60.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495103,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,15.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495104,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,506.20451,[M+FA]-,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495105,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,462.21358,[M+H]+,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495106,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,462.21358,[M+H]+,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495107,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,462.21358,[M+H]+,60.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495108,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,462.21358,[M+H]+,30.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495109,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1,462.21358,[M+H]+,20.0,val,CC(=O)Nc1ccc(CC(=O)N2CCCC(c3nc(-c4ccc(NC(C)=O)cc4)no3)C2)cc1
495110,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2,390.20637,[M+H]+,20.0,val,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2
495111,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2,390.20637,[M+H]+,20.0,val,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2
495112,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2,390.20637,[M+H]+,60.0,val,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2
495113,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2,390.20637,[M+H]+,15.0,val,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2
495114,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2,390.20637,[M+H]+,20.0,val,CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC12CCCC2
495115,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,20.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495116,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,20.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495117,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,60.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495118,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,20.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495119,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,45.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495120,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,60.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495121,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,20.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495122,CN1CCN(c2cnc3c(C4CCN(C(=O)c5c(N)cc(OC(F)(F)F)cc5)CC4)ncnc3c2)CC1,516.23293,[M+H]+,45.0,val,CN1CCN(c2cnc3c(C4CCN(C(=O)c5ccc(OC(F)(F)F)cc5N)CC4)ncnc3c2)CC1
495123,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,20.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495124,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,20.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495125,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,30.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495126,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,60.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495127,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,20.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495128,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,45.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495129,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,60.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495130,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1,434.23506,[M+H]+,20.0,val,COc1ccccc1CN1CCc2nc(N3CCN(c4ccccc4F)CC3)ncc2C1
495131,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495132,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495133,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495134,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495135,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495136,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495137,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495138,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495139,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495140,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495141,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495142,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,30.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495143,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495144,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495145,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495146,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495147,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495148,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495149,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495150,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495151,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,619.11088,[M-H]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495152,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,655.08756,[M+Cl]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495153,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,655.08756,[M+Cl]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495154,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,655.08756,[M+Cl]-,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495155,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,655.08756,[M+Cl]-,15.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495156,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,655.08756,[M+Cl]-,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495157,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495158,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495159,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495160,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,30.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495161,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495162,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,60.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495163,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,30.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495164,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3c(C)ncs3)CS[C@H]12)c1csc(N)n1,621.12544,[M+H]+,20.0,val,CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(/C=C\c3scnc3C)CS[C@H]12)c1csc(N)n1
495165,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495166,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495167,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495168,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,30.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495169,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495170,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495171,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,30.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495172,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495173,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495174,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495175,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495176,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,15.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495177,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495178,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495179,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,15.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495180,COc1c(O)cc2oc3c(c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)c(=O)c2c1,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3oc2cc1O
495181,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495182,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495183,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,45.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495184,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495185,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495186,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,45.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495187,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495188,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,567.13554,[M-H]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495189,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,603.11222,[M+Cl]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495190,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,603.11222,[M+Cl]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495191,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,603.11222,[M+Cl]-,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495192,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,603.11222,[M+Cl]-,15.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495193,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,603.11222,[M+Cl]-,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495194,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495195,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495196,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495197,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,15.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495198,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495199,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,60.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495200,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,20.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495201,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O,569.1501,[M+H]+,15.0,val,COc1cc2c(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@](O)(CO)[C@H]4O)c(O)cc3oc2cc1O
495202,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,503.23879,[M]+,30.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495203,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,503.23879,[M]+,30.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495204,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,503.23879,[M]+,20.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495205,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,503.23879,[M]+,60.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495206,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,503.23879,[M]+,30.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495207,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,20.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495208,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,20.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495209,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,60.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495210,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,20.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495211,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,45.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495212,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,60.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495213,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,20.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495214,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1,504.24661,[M+H]+,45.0,val,COCCOc1ccc(N2CCN(CCn3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
495215,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,537.15647,[M+FA]-,20.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495216,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,537.15647,[M+FA]-,60.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495217,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,537.15647,[M+FA]-,15.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495218,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,537.15647,[M+FA]-,20.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495219,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,493.16554,[M+H]+,20.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495220,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,493.16554,[M+H]+,20.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495221,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,493.16554,[M+H]+,60.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495222,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,493.16554,[M+H]+,30.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
495223,Cc1c(OC(C)C(=O)N2CCCN(C(=O)C(C)Oc3c(C)cc(Cl)cc3)CC2)ccc(Cl)c1,493.16554,[M+H]+,20.0,val,Cc1cc(Cl)ccc1OC(C)C(=O)N1CCCN(C(=O)C(C)Oc2ccc(Cl)cc2C)CC1
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495225,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495226,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495227,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495228,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495229,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495230,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495231,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495232,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495233,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495234,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495235,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495236,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495237,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,629.11482,[M+Cl]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495238,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,629.11482,[M+Cl]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495239,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,629.11482,[M+Cl]-,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495240,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,629.11482,[M+Cl]-,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495241,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,629.11482,[M+Cl]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495242,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495243,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495244,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495245,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495246,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495247,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495248,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495249,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,593.13815,[M-H]-,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495250,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495251,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495252,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495253,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,30.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495254,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495255,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495256,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,30.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495257,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)CC2S(=O)(=O)C1(C)C
495258,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495259,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495260,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,595.1527,[M+H]+,60.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495261,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,595.1527,[M+H]+,15.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495262,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C,595.1527,[M+H]+,20.0,val,CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
495263,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,477.20782,[M-H]-,30.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495264,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,477.20782,[M-H]-,30.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495265,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,477.20782,[M-H]-,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495266,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,477.20782,[M-H]-,60.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495267,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,477.20782,[M-H]-,30.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495268,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495269,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495270,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,60.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495271,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,15.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495272,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495273,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,60.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495274,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,15.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495275,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,523.2133,[M+FA]-,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495276,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495277,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495278,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,60.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495279,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,30.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495280,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495281,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,60.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495282,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,30.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495283,Cc1cc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)ccc1,479.22237,[M+H]+,20.0,val,Cc1cccc(C(=O)NCCc2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)c1
495284,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,569.15119,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495285,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,569.15119,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495286,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,569.15119,[M-H]-,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495287,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,569.15119,[M-H]-,30.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495288,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,569.15119,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495289,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,605.12787,[M+Cl]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495290,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,605.12787,[M+Cl]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495291,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,605.12787,[M+Cl]-,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495292,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,605.12787,[M+Cl]-,15.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495293,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,605.12787,[M+Cl]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495294,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,571.16575,[M+H]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495295,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,571.16575,[M+H]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495296,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,571.16575,[M+H]+,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495297,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,571.16575,[M+H]+,30.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495298,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1,571.16575,[M+H]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C(=O)O)C1CC(=O)OCCc1ccc(O)c(O)c1
495299,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1,374.25907,[M+H]+,20.0,val,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
495300,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1,374.25907,[M+H]+,20.0,val,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
495301,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1,374.25907,[M+H]+,60.0,val,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
495302,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1,374.25907,[M+H]+,20.0,val,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
495303,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1,374.25907,[M+H]+,45.0,val,CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1
495304,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,416.24559,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495305,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,416.24559,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495306,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,416.24559,[M-H]-,60.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495307,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,416.24559,[M-H]-,30.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495308,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,416.24559,[M-H]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495309,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,462.25106,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495310,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,462.25106,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495311,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,462.25106,[M+FA]-,60.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495312,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,462.25106,[M+FA]-,15.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495313,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,462.25106,[M+FA]-,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495314,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495315,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495316,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,45.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495317,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,60.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495318,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495319,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,60.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495320,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,45.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495321,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1,418.26014,[M+H]+,20.0,val,O=C(CCc1ccccc1)N1CCCC2(C1)Nc1cccnc1N=C2NC1CCCC1
495322,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495323,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495324,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495325,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,30.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495326,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495327,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495328,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495329,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,432.22274,[M-H]-,30.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495330,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495331,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495332,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495333,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,15.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495334,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495335,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,15.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495336,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495337,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,468.19942,[M+Cl]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495338,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495339,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495340,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495341,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,15.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495342,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495343,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,15.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495344,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495345,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,478.22822,[M+FA]-,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495346,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495347,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495348,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495349,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,30.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495350,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495351,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,60.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495352,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,30.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495353,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1,434.23729,[M+H]+,20.0,val,Cc1cccc(CCNC(=S)Nc2ccc3nc(N4CCN(C)CC4)cc(C)c3c2)c1
495354,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495355,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495356,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495357,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495358,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,45.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495359,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495360,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495361,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495362,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495363,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,45.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495364,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495365,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495366,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495367,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495368,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,45.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495369,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495370,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495371,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,45.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495372,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495373,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495374,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495375,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,30.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495376,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495377,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,60.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495378,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,30.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495379,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1
495380,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495381,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495382,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,60.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495383,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495384,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,45.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495385,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,60.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495386,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495387,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,423.22893,[M-H]-,45.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495388,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495389,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495390,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,30.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495391,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,60.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495392,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495393,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,45.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495394,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,60.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495395,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cc(O)ccc1,425.24348,[M+H]+,20.0,val,CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CC[C@]1(C)c1cccc(O)c1
495396,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,423.22893,[M-H]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495397,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,423.22893,[M-H]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495398,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,423.22893,[M-H]-,60.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495399,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,423.22893,[M-H]-,15.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495400,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,423.22893,[M-H]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495401,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,469.23441,[M+FA]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495402,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,469.23441,[M+FA]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495403,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,469.23441,[M+FA]-,60.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495404,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,469.23441,[M+FA]-,15.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495405,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,469.23441,[M+FA]-,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495406,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495407,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495408,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,60.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495409,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,15.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495410,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495411,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,60.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495412,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,15.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495413,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1,425.24348,[M+H]+,20.0,val,COC(=O)CCCNC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
495414,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,439.22385,[M-H]-,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495415,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,439.22385,[M-H]-,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495416,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,439.22385,[M-H]-,60.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495417,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,439.22385,[M-H]-,45.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495418,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,441.2384,[M+H]+,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495419,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,441.2384,[M+H]+,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495420,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,441.2384,[M+H]+,15.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495421,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,441.2384,[M+H]+,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495422,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1,441.2384,[M+H]+,20.0,val,CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2COc3ccccc3O2)cc1
495423,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,439.22385,[M-H]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495424,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,439.22385,[M-H]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495425,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,439.22385,[M-H]-,60.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495426,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,439.22385,[M-H]-,30.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495427,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,439.22385,[M-H]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495428,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,485.22932,[M+FA]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495429,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,485.22932,[M+FA]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495430,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,485.22932,[M+FA]-,60.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495431,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,485.22932,[M+FA]-,15.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495432,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,485.22932,[M+FA]-,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495433,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,485.22932,[M+FA]-,60.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495434,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,485.22932,[M+FA]-,15.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495435,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,485.22932,[M+FA]-,20.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495436,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,20.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495437,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,20.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495438,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,15.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495439,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,60.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495440,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,30.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495441,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,20.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495442,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,20.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495443,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC,441.2384,[M+H]+,60.0,val,CCOc1ccc(CCNC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1OCC
495444,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1,441.2384,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1
495445,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1,441.2384,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1
495446,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1,441.2384,[M+H]+,60.0,val,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1
495447,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1,441.2384,[M+H]+,30.0,val,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1
495448,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1,441.2384,[M+H]+,20.0,val,CCN(CC)C(=O)C1CCC(=O)N(c2ccc(OC)cc2)C1c1ccc(OC)c(OC)c1
495449,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495450,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495451,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,60.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495452,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,30.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495453,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495454,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,30.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495455,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495456,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,441.2384,[M+H]+,60.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495457,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,463.22034,[M+Na]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495458,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,463.22034,[M+Na]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495459,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,463.22034,[M+Na]+,45.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495460,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1,463.22034,[M+Na]+,20.0,val,COc1cccc(OCC(=O)Nc2ccc3c(c2)N(CCC(C)C)C(=O)C(C)(C)CO3)c1
495461,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12,351.26825,[M+H-H2O]+,20.0,val,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12
495462,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12,351.26825,[M+H-H2O]+,20.0,val,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12
495463,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12,351.26825,[M+H-H2O]+,60.0,val,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12
495464,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12,351.26825,[M+H-H2O]+,30.0,val,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12
495465,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12,351.26825,[M+H-H2O]+,20.0,val,CC(C)=C/C=C\[C@H](C)[C@H]1CC[C@]2(C)C[C@@H]3C(C)=CC(=O)C3/C(CO)=C\C[C@@H]12
495466,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495467,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495468,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,15.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495469,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,60.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495470,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,30.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495471,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495472,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,60.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495473,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,400.28463,[M+H-H2O]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495474,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,440.27713,[M+Na]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495475,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O,440.27713,[M+Na]+,20.0,val,COC1CC(=O)C23C(=O)NC(CC(C)C)C2C(C)C(C)=CC3C=C(C)CCCC1O
495476,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495477,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495478,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,60.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495479,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495480,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,45.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495481,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,60.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495482,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495483,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,402.30137,[M-H]-,45.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495484,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495485,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495486,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,60.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495487,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,15.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495488,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495489,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,60.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495490,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,15.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495491,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O,404.31592,[M+H]+,20.0,val,CC(C)CCCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)O
495492,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,388.32101,[M+H-H2O]+,20.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495493,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,388.32101,[M+H-H2O]+,20.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495494,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,388.32101,[M+H-H2O]+,60.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495495,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,388.32101,[M+H-H2O]+,30.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495496,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,388.32101,[M+H-H2O]+,20.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495497,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,406.33157,[M+H]+,30.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495498,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,406.33157,[M+H]+,30.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495499,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,406.33157,[M+H]+,20.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495500,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,406.33157,[M+H]+,60.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495501,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO,406.33157,[M+H]+,30.0,val,CCCCC/C=C/C(CCCCCCC/C=C/C=C/C(=O)N1CCCCC1)OO
495502,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,20.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495503,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,20.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495504,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,60.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495505,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,30.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495506,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,20.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495507,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,60.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495508,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,30.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495509,Cn1nc(C(F)(F)F)cc1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OCc2ccc(Cl)cc2)cc1,593.06838,[M-H]-,20.0,val,Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1O
495510,O=C(Nc1cc2c(cc1)nccc2)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12,440.11603,[M+H]+,20.0,val,O=C(Nc1ccc2ncccc2c1)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
495511,O=C(Nc1cc2c(cc1)nccc2)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12,440.11603,[M+H]+,20.0,val,O=C(Nc1ccc2ncccc2c1)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
495512,O=C(Nc1cc2c(cc1)nccc2)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12,440.11603,[M+H]+,60.0,val,O=C(Nc1ccc2ncccc2c1)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
495513,O=C(Nc1cc2c(cc1)nccc2)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12,440.11603,[M+H]+,20.0,val,O=C(Nc1ccc2ncccc2c1)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
495514,O=C(Nc1cc2c(cc1)nccc2)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12,440.11603,[M+H]+,45.0,val,O=C(Nc1ccc2ncccc2c1)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
495515,O=C1/C(=C/c2cc(Br)c(O)cc2)CN(Cc2ccccc2)C/C1=C\c1cc(Br)c(O)cc1,553.99609,[M+H]+,30.0,val,O=C1/C(=C/c2ccc(O)c(Br)c2)CN(Cc2ccccc2)C/C1=C\c1ccc(O)c(Br)c1
495516,O=C1/C(=C/c2cc(Br)c(O)cc2)CN(Cc2ccccc2)C/C1=C\c1cc(Br)c(O)cc1,553.99609,[M+H]+,30.0,val,O=C1/C(=C/c2ccc(O)c(Br)c2)CN(Cc2ccccc2)C/C1=C\c1ccc(O)c(Br)c1
495517,O=C1/C(=C/c2cc(Br)c(O)cc2)CN(Cc2ccccc2)C/C1=C\c1cc(Br)c(O)cc1,553.99609,[M+H]+,20.0,val,O=C1/C(=C/c2ccc(O)c(Br)c2)CN(Cc2ccccc2)C/C1=C\c1ccc(O)c(Br)c1
495518,O=C1/C(=C/c2cc(Br)c(O)cc2)CN(Cc2ccccc2)C/C1=C\c1cc(Br)c(O)cc1,553.99609,[M+H]+,60.0,val,O=C1/C(=C/c2ccc(O)c(Br)c2)CN(Cc2ccccc2)C/C1=C\c1ccc(O)c(Br)c1
495519,O=C1/C(=C/c2cc(Br)c(O)cc2)CN(Cc2ccccc2)C/C1=C\c1cc(Br)c(O)cc1,553.99609,[M+H]+,30.0,val,O=C1/C(=C/c2ccc(O)c(Br)c2)CN(Cc2ccccc2)C/C1=C\c1ccc(O)c(Br)c1
495520,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495521,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495522,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,30.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495523,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,60.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495524,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495525,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,45.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495526,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,60.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495527,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495528,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495529,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495530,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,30.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495531,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,60.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495532,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495533,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,45.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495534,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,60.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495535,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1,392.17574,[M+H]+,20.0,val,O=C1N(c2ccccc2)c2ccccc2C1(Cc1ccncc1)Cc1ccncc1
495536,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,466.17971,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495537,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,466.17971,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495538,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,466.17971,[M-H]-,60.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495539,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,466.17971,[M-H]-,30.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495540,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,466.17971,[M-H]-,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495541,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495542,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495543,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,60.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495544,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495545,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,60.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495546,Cc1nn(C)c(C(=O)Nc2c(F)ccc(Nc3cc4c(cc3)c(/C=C/c3ccccn3)n[nH]4)c2)c1,468.19426,[M+H]+,20.0,val,Cc1cc(C(=O)Nc2cc(Nc3ccc4c(/C=C/c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1
495547,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495548,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495549,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,60.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495550,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,30.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495551,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495552,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,60.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495553,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,30.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495554,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,469.15174,[M-H]-,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495555,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,471.1663,[M+H]+,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495556,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,471.1663,[M+H]+,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495557,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,471.1663,[M+H]+,60.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495558,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,471.1663,[M+H]+,15.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495559,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1,471.1663,[M+H]+,20.0,val,COc1ccc(C2CC(c3c(O)cc(C)oc3=O)=Nc3c(C(=O)Nc4ccccc4)cnn32)cc1
495560,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,20.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495561,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,20.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495562,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,60.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495563,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,20.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495564,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,60.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495565,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O,431.14891,[M+H]+,20.0,val,COc1ccccc1-c1c(C)oc2cc(OCC(=O)OCc3ccccc3)ccc2c1=O
495566,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495567,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495568,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495569,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495570,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,45.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495571,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495572,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495573,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,440.16158,[M-H]-,45.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495574,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495575,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495576,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495577,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,30.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495578,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495579,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,60.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495580,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,30.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495581,O=C1c2c(c(-c3ccccc3O)n[nH]2)C(c2cc(Oc3ccccc3)ccc2)N1CCCO,442.17613,[M+H]+,20.0,val,O=C1c2[nH]nc(-c3ccccc3O)c2C(c2cccc(Oc3ccccc3)c2)N1CCCO
495582,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495583,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495584,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,60.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495585,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,15.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495586,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495587,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,60.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495588,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,15.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495589,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1,442.17613,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)c1cn(Cc2ccccc2)nc1OCc1ccccc1
495590,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495591,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495592,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,60.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495593,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,30.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495594,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495595,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,30.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495596,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,20.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495597,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12,442.17613,[M+H]+,60.0,val,COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1COc1cccc2cccnc12
495598,CC1(O)CC(c2nc(-c3cc4c(cc3)ccc(-c3ccccc3)n4)c3c(N)nccn23)C1,422.19754,[M+H]+,20.0,val,CC1(O)CC(c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(N)nccn23)C1
495599,CC1(O)CC(c2nc(-c3cc4c(cc3)ccc(-c3ccccc3)n4)c3c(N)nccn23)C1,422.19754,[M+H]+,20.0,val,CC1(O)CC(c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(N)nccn23)C1
495600,CC1(O)CC(c2nc(-c3cc4c(cc3)ccc(-c3ccccc3)n4)c3c(N)nccn23)C1,422.19754,[M+H]+,60.0,val,CC1(O)CC(c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(N)nccn23)C1
495601,CC1(O)CC(c2nc(-c3cc4c(cc3)ccc(-c3ccccc3)n4)c3c(N)nccn23)C1,422.19754,[M+H]+,20.0,val,CC1(O)CC(c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(N)nccn23)C1
495602,CC1(O)CC(c2nc(-c3cc4c(cc3)ccc(-c3ccccc3)n4)c3c(N)nccn23)C1,422.19754,[M+H]+,45.0,val,CC1(O)CC(c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(N)nccn23)C1
495603,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,420.18298,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495604,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,420.18298,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495605,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,420.18298,[M-H]-,60.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495606,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,420.18298,[M-H]-,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495607,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,420.18298,[M-H]-,45.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495608,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,456.15966,[M+Cl]-,15.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495609,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,456.15966,[M+Cl]-,15.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495610,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,456.15966,[M+Cl]-,60.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495611,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,456.15966,[M+Cl]-,15.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495612,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495613,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495614,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,30.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495615,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495616,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495617,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,45.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495618,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,60.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495619,CC(C)[C@H](NC(=O)c1cc(-c2cnccc2)nc2ccccc12)c1nc2ccccc2[nH]1,422.19754,[M+H]+,20.0,val,CC(C)[C@H](NC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nc2ccccc2[nH]1
495620,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,20.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495621,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,20.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495622,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,60.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495623,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,30.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495624,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,20.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495625,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,60.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495626,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,30.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495627,COc1c(OCc2nc3ccccc3cc2)cc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1,454.18737,[M+H]+,20.0,val,COc1ccc(NC(=O)c2cc(C)nc3cc(C)nn23)cc1OCc1ccc2ccccc2n1
495628,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495629,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495630,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,60.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495631,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,15.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495632,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495633,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,60.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495634,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,15.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495635,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,460.14018,[M-H]-,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495636,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495637,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495638,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,60.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495639,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,15.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495640,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495641,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,60.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495642,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,15.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495643,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1,462.15473,[M+H]+,20.0,val,CCc1ccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(=O)O)cc1
495644,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,542.14792,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495645,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,542.14792,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495646,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,542.14792,[M-H]-,60.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495647,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,542.14792,[M-H]-,30.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495648,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,542.14792,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495649,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,578.1246,[M+Cl]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495650,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,578.1246,[M+Cl]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495651,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,578.1246,[M+Cl]-,60.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495652,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,578.1246,[M+Cl]-,30.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495653,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,578.1246,[M+Cl]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495654,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495655,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495656,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,60.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495657,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,15.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495658,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495659,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,60.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495660,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,15.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495661,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,588.1534,[M+FA]-,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495662,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,544.16247,[M+H]+,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495663,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,544.16247,[M+H]+,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495664,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,544.16247,[M+H]+,60.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495665,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,544.16247,[M+H]+,30.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495666,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1,544.16247,[M+H]+,20.0,val,NS(=O)(=O)c1ccc(-n2nc(CCCNC(=O)Nc3ccc(C(F)(F)F)cc3)cc2-c2ccccc2)cc1
495667,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495668,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495669,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,60.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495670,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,15.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495671,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495672,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,60.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495673,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,15.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495674,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,518.18452,[M+FA]-,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495675,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495676,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495677,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,45.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495678,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,60.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495679,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495680,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,45.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495681,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,60.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495682,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1,474.19359,[M+H]+,20.0,val,O=C(NCc1ccc2c(c1)OCO2)C1CCCN(c2nccn3nc(-c4ccc(F)cc4)cc23)C1
495683,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,20.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495684,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,20.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495685,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,30.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495686,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,60.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495687,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,20.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495688,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,45.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495689,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,60.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495690,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1cc(N2CCN(C3CC3)CC2)ncc1,526.21728,[M+H]+,20.0,val,Cc1cc(-c2nc(-c3ccc(OC(F)(F)F)cc3)no2)nn1Cc1ccnc(N2CCN(C3CC3)CC2)c1
495691,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495692,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495693,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,60.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495694,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495695,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,45.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495696,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,60.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495697,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,445.15914,[M-H]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495698,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,481.13581,[M+Cl]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495699,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,481.13581,[M+Cl]-,60.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495700,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,491.16462,[M+FA]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495701,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,491.16462,[M+FA]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495702,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,491.16462,[M+FA]-,60.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495703,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,491.16462,[M+FA]-,15.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495704,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,491.16462,[M+FA]-,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495705,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,447.17369,[M+H]+,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495706,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,447.17369,[M+H]+,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495707,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,447.17369,[M+H]+,60.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495708,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,447.17369,[M+H]+,30.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495709,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3,447.17369,[M+H]+,20.0,val,O=C1Cc2cc(S(=O)(=O)NCCC(c3ccccc3)c3ccccc3)cc3c2N1CCC3
495710,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,585.09417,[M-H]-,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495711,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,585.09417,[M-H]-,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495712,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,585.09417,[M-H]-,60.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495713,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,585.09417,[M-H]-,30.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495714,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,585.09417,[M-H]-,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495715,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,587.10872,[M+H]+,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495716,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,587.10872,[M+H]+,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495717,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,587.10872,[M+H]+,60.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495718,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,587.10872,[M+H]+,30.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495719,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1,587.10872,[M+H]+,20.0,val,COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2cccs2)n1
495720,C=CC(=O)Nc1cc(Oc2c3occc3nc(Nc3ccc(N4CCN(C)CC4)cc3)n2)ccc1,471.21391,[M+H]+,20.0,val,C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)nc3ccoc23)c1
495721,C=CC(=O)Nc1cc(Oc2c3occc3nc(Nc3ccc(N4CCN(C)CC4)cc3)n2)ccc1,471.21391,[M+H]+,60.0,val,C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)nc3ccoc23)c1
495722,C=CC(=O)Nc1cc(Oc2c3occc3nc(Nc3ccc(N4CCN(C)CC4)cc3)n2)ccc1,471.21391,[M+H]+,45.0,val,C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)nc3ccoc23)c1
495723,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2,447.19461,[M+H]+,20.0,val,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2
495724,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2,447.19461,[M+H]+,20.0,val,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2
495725,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2,447.19461,[M+H]+,45.0,val,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2
495726,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2,447.19461,[M+H]+,60.0,val,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2
495727,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2,447.19461,[M+H]+,20.0,val,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc2c1C(=O)CC(c1ccc(Cl)cc1)C2
495728,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495729,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495730,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495731,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495732,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495733,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,60.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495734,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,30.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495735,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,428.19797,[M-H]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495736,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,464.17464,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495737,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,464.17464,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495738,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,464.17464,[M+Cl]-,15.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495739,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,464.17464,[M+Cl]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495740,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,474.20344,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495741,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,474.20344,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495742,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,474.20344,[M+FA]-,60.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495743,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,474.20344,[M+FA]-,15.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495744,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,474.20344,[M+FA]-,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495745,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495746,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495747,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,60.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495748,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495749,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495750,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,60.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495751,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,15.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495752,CC(=O)c1cc(NC(=O)Cn2nc(-c3c(C)ccc(C)c3)c3c(CCCC3)c2=O)ccc1,430.21252,[M+H]+,20.0,val,CC(=O)c1cccc(NC(=O)Cn2nc(-c3cc(C)ccc3C)c3c(c2=O)CCCC3)c1
495753,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495754,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495755,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495756,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,15.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495757,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495758,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495759,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495760,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,490.19836,[M+FA]-,15.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495761,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,444.19288,[M-H]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495762,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,444.19288,[M-H]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495763,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,444.19288,[M-H]-,60.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495764,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,444.19288,[M-H]-,30.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495765,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,444.19288,[M-H]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495766,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,480.16956,[M+Cl]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495767,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,480.16956,[M+Cl]-,15.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495768,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,480.16956,[M+Cl]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495769,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495770,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495771,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,60.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495772,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,15.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495773,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495774,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495775,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,15.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495776,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,490.19836,[M+FA]-,60.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495777,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495778,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495779,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,15.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495780,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,60.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495781,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,30.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495782,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495783,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,20.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495784,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC,446.20743,[M+H]+,60.0,val,COc1ccc(N2CC(NC(=O)NC(c3ccccc3)c3ccccc3)CC2=O)cc1OC
495785,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495786,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495787,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,60.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495788,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,30.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495789,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495790,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,60.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495791,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,30.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495792,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,410.18631,[M+H-2H2O]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495793,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,446.20743,[M+H]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495794,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,446.20743,[M+H]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495795,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,446.20743,[M+H]+,60.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495796,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,446.20743,[M+H]+,30.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495797,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C,446.20743,[M+H]+,20.0,val,Cc1oc2cc3oc(=O)c(CCC(=O)N4CCN(c5ccccn5)CC4)c(C)c3cc2c1C
495798,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495799,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495800,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495801,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495802,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495803,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,45.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495804,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,60.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495805,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2,446.20743,[M+H]+,20.0,val,COc1cn2c(cc1=O)C(=O)N(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC2
495806,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,20.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495807,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,20.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495808,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,60.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495809,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,20.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495810,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,60.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495811,Nc1cc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)ccc1,438.24007,[M+H]+,20.0,val,Nc1cccc(Nc2nc(N3CCCCC3)nc(N(c3ccccc3)c3ccccc3)n2)c1
495812,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495813,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495814,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,30.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495815,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495816,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495817,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495818,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495819,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495820,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495821,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495822,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495823,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,30.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495824,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495825,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495826,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495827,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495828,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495829,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495830,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495831,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495832,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495833,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495834,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495835,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495836,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495837,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495838,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495839,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,30.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495840,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495841,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495842,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495843,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495844,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495845,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495846,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495847,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,30.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495848,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495849,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495850,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495851,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,30.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495852,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495853,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1
495854,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495855,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495856,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495857,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495858,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495859,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,60.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495860,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,20.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495861,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1,406.19322,[M+H]+,45.0,val,CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
495862,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,459.18602,[M-H]-,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495863,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,459.18602,[M-H]-,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495864,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,459.18602,[M-H]-,60.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495865,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,459.18602,[M-H]-,30.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495866,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,459.18602,[M-H]-,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495867,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495868,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495869,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,60.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495870,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,30.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495871,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495872,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,60.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495873,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,30.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495874,CCn1c2ccccc2c2c1ccc(/C=N/NC(=O)C(NC(=O)Cc1cccs1)C(C)C)c2,461.20057,[M+H]+,20.0,val,CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)Cc3cccs3)C(C)C)ccc21
495875,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,595.13046,[M-H]-,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495876,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,595.13046,[M-H]-,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495877,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,595.13046,[M-H]-,60.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495878,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,595.13046,[M-H]-,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495879,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,595.13046,[M-H]-,45.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495880,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,596.13774,[M]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495881,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,596.13774,[M]-,20.0,val,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495882,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,596.13774,[M]-,45.0,val,O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495883,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,597.14501,[M+H]+,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495884,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,597.14501,[M+H]+,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495885,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,597.14501,[M+H]+,60.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495886,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,597.14501,[M+H]+,15.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495887,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2cc(O)c(O)cc2)oc2cc(O)cc(O)c12,597.14501,[M+H]+,20.0,val,O=c1c(OC2OC(CO)C(O)C(O)C2O[C@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
495888,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1,433.23982,[M+H]+,20.0,val,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1
495889,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1,433.23982,[M+H]+,20.0,val,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1
495890,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1,433.23982,[M+H]+,60.0,val,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1
495891,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1,433.23982,[M+H]+,30.0,val,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1
495892,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1,433.23982,[M+H]+,20.0,val,O=C(NC1CCCCC1)c1ccc2ccnc(N3CCN(c4ccccc4F)CC3)c2c1
495893,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,516.23648,[M+FA]-,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495894,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,516.23648,[M+FA]-,15.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495895,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,516.23648,[M+FA]-,15.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495896,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,516.23648,[M+FA]-,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495897,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,516.23648,[M+FA]-,60.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495898,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495899,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495900,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,60.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495901,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,30.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495902,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495903,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,60.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495904,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,30.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495905,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1,472.24555,[M+H]+,20.0,val,Cc1cc(C)cc(-n2ccn3c(CCCC(=O)N4CCN(c5ccccn5)CC4)nnc3c2=O)c1
495906,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495907,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495908,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,60.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495909,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495910,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,45.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495911,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495912,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495913,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,60.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495914,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,20.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495915,COc1cc2c(-c3c4ncc(N5CCC(N6CCN(C)CC6)CC5)cn4nc3)ccnc2cc1F,476.25686,[M+H]+,45.0,val,COc1cc2c(-c3cnn4cc(N5CCC(N6CCN(C)CC6)CC5)cnc34)ccnc2cc1F
495916,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,463.22385,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495917,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,463.22385,[M+FA]-,60.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495918,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,463.22385,[M+FA]-,15.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495919,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,463.22385,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495920,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,419.23292,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495921,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,419.23292,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495922,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,419.23292,[M+H]+,30.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495923,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,419.23292,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
495924,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1,419.23292,[M+H]+,15.0,val,CC(C)Oc1ccc(C(=O)NCC(c2cccc3ccccc23)N2CCOCC2)cc1
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495948,C=C[C@H]1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)C3CC21,543.19842,[M+FA]-,60.0,val,C=C[C@H]1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)C3CC21
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495971,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,497.19294,[M-H]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495972,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,497.19294,[M-H]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495973,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,497.19294,[M-H]-,30.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495974,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,497.19294,[M-H]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495975,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,533.16962,[M+Cl]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495976,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,533.16962,[M+Cl]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495977,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,533.16962,[M+Cl]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495978,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,533.16962,[M+Cl]-,30.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495979,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,533.16962,[M+Cl]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495980,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495981,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495982,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495983,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,15.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495984,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495985,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495986,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495987,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,543.19842,[M+FA]-,15.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495988,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495989,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495990,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495991,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,30.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495992,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495993,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495994,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495995,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,499.20749,[M+H]+,30.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]21
495996,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,445.22451,[M-H]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
495997,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,445.22451,[M-H]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
495998,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,445.22451,[M-H]-,60.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
495999,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,445.22451,[M-H]-,30.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496000,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,445.22451,[M-H]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496001,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,491.22999,[M+FA]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496002,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,491.22999,[M+FA]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496003,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,491.22999,[M+FA]-,60.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496004,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,491.22999,[M+FA]-,15.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496005,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,491.22999,[M+FA]-,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496006,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,447.23907,[M+H]+,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496007,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,447.23907,[M+H]+,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496008,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,447.23907,[M+H]+,60.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496009,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,447.23907,[M+H]+,15.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496010,COc1cc2c(cc1)n(C)c(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)c2,447.23907,[M+H]+,20.0,val,COc1ccc2c(c1)cc(C(=O)N[C@H](C(=O)NCCc1c[nH]c3ccccc13)C(C)C)n2C
496011,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496012,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496013,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,60.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496014,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,15.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496015,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496016,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,60.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496017,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496018,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,491.22999,[M+FA]-,15.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496019,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496020,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496021,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,15.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496022,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496023,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,30.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496024,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496025,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,60.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496026,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1,447.23907,[M+H]+,20.0,val,Cc1nc2ccccc2c(=O)n1CC1CCN(C(=O)c2ccc(N3CCOCC3)cc2)CC1
496027,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,447.23907,[M+H]+,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496028,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,447.23907,[M+H]+,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496029,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,447.23907,[M+H]+,60.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496030,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,447.23907,[M+H]+,15.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496031,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC,447.23907,[M+H]+,20.0,val,COc1ccc(CCNC(=O)C2CCN(c3ccc(-c4ccccc4)nn3)CC2)cc1OC
496032,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496033,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496034,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,60.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496035,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,30.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496036,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496037,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,60.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496038,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,30.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496039,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,464.21909,[M-H]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496040,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,500.19577,[M+Cl]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496041,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,500.19577,[M+Cl]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496042,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,500.19577,[M+Cl]-,60.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496043,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,500.19577,[M+Cl]-,15.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496044,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,500.19577,[M+Cl]-,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496045,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496046,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496047,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,60.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496048,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,30.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496049,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496050,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,60.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496051,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,30.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496052,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1,466.23365,[M+H]+,20.0,val,CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1
496053,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,538.19521,[M+FA]-,20.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496054,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,538.19521,[M+FA]-,60.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496055,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,20.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496056,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,20.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496057,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,60.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496058,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,30.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496059,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,20.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496060,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,60.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496061,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,30.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496062,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4c(C)ccc(C)c4)CC3)n2)cc1,494.20428,[M+H]+,20.0,val,CSc1ccc(CNC(=O)CSc2nccc(N3CCN(c4cc(C)ccc4C)CC3)n2)cc1
496063,Cc1nn(-c2nn3c(C)nnc3cc2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1,458.26628,[M+H]+,20.0,val,Cc1nn(-c2ccc3nnc(C)n3n2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1
496064,Cc1nn(-c2nn3c(C)nnc3cc2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1,458.26628,[M+H]+,20.0,val,Cc1nn(-c2ccc3nnc(C)n3n2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1
496065,Cc1nn(-c2nn3c(C)nnc3cc2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1,458.26628,[M+H]+,60.0,val,Cc1nn(-c2ccc3nnc(C)n3n2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1
496066,Cc1nn(-c2nn3c(C)nnc3cc2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1,458.26628,[M+H]+,20.0,val,Cc1nn(-c2ccc3nnc(C)n3n2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1
496067,Cc1nn(-c2nn3c(C)nnc3cc2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1,458.26628,[M+H]+,60.0,val,Cc1nn(-c2ccc3nnc(C)n3n2)c(C)c1CCC(=O)N1CCC(Cc2ccccc2)CC1
496068,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496069,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496070,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,60.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496071,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,30.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496072,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496073,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,60.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496074,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,30.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496075,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496076,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496077,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496078,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,60.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496079,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,30.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496080,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C,479.19951,[M+H]+,20.0,val,CCCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@@]21C
496081,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496082,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496083,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,60.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496084,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496085,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,45.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496086,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,60.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496087,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496088,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,556.20807,[M-H]-,45.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496089,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,592.18475,[M+Cl]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496090,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,592.18475,[M+Cl]-,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496091,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,592.18475,[M+Cl]-,60.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496092,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,558.22262,[M+H]+,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496093,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,558.22262,[M+H]+,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496094,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,558.22262,[M+H]+,60.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496095,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,558.22262,[M+H]+,30.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496096,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O,558.22262,[M+H]+,20.0,val,CNC(=O)COc1cc2cc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc(OC)c2n(C)c1=O
496097,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,465.2395,[M+FA]-,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496098,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,465.2395,[M+FA]-,60.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496099,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,465.2395,[M+FA]-,15.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496100,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,465.2395,[M+FA]-,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496101,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496102,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496103,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,60.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496104,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,15.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496105,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496106,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,60.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496107,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,15.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496108,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1)N1CCCC(O)CC1,421.24857,[M+H]+,20.0,val,O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1)N1CCCC(O)CC1
496109,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,565.19266,[M+FA]-,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496110,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,565.19266,[M+FA]-,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496111,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,565.19266,[M+FA]-,60.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496112,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,565.19266,[M+FA]-,15.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496113,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,565.19266,[M+FA]-,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496114,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,521.20174,[M+H]+,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496115,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,521.20174,[M+H]+,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496116,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,521.20174,[M+H]+,60.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496117,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,521.20174,[M+H]+,15.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496118,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24,521.20174,[M+H]+,20.0,val,COC(=O)[C@@]12OC[C@]34[C@H]([C@@H](O)[C@@H]1O)[C@@]1(C)CC(=O)C(O)=C(C)[C@@H]1C[C@H]3OC(=O)[C@H](OC(=O)C=C(C)C)[C@@H]24
496119,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,565.19266,[M+FA]-,20.0,val,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
496120,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,565.19266,[M+FA]-,20.0,val,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
496121,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,565.19266,[M+FA]-,60.0,val,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
496122,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,565.19266,[M+FA]-,15.0,val,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
496123,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,565.19266,[M+FA]-,20.0,val,Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
496124,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496125,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496126,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,60.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496127,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,15.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496128,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496129,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,60.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496130,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,15.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496131,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,519.18719,[M-H]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496132,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,555.16386,[M+Cl]-,30.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496133,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,555.16386,[M+Cl]-,30.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496134,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,555.16386,[M+Cl]-,60.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496135,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,555.16386,[M+Cl]-,30.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496136,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,565.19266,[M+FA]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496137,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,565.19266,[M+FA]-,20.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496138,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,565.19266,[M+FA]-,30.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
496139,COc1c(O)ccc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)cc4)OCC23)c1,565.19266,[M+FA]-,60.0,val,COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O
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496162,COc1c(OC2OC(CO)C(O)C(O)C2O)ccc([C@H]2Oc3c(cc(/C=C/CO)cc3OC)[C@H]2CO)c1,538.22829,[M+NH4]+,20.0,val,COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1OC1OC(CO)C(O)C(O)C1O
496163,COc1c(OC2OC(CO)C(O)C(O)C2O)ccc([C@H]2Oc3c(cc(/C=C/CO)cc3OC)[C@H]2CO)c1,538.22829,[M+NH4]+,20.0,val,COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1OC1OC(CO)C(O)C(O)C1O
496164,COc1c(OC2OC(CO)C(O)C(O)C2O)ccc([C@H]2Oc3c(cc(/C=C/CO)cc3OC)[C@H]2CO)c1,538.22829,[M+NH4]+,60.0,val,COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1OC1OC(CO)C(O)C(O)C1O
496165,COc1c(OC2OC(CO)C(O)C(O)C2O)ccc([C@H]2Oc3c(cc(/C=C/CO)cc3OC)[C@H]2CO)c1,538.22829,[M+NH4]+,15.0,val,COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1OC1OC(CO)C(O)C(O)C1O
496166,COc1c(OC2OC(CO)C(O)C(O)C2O)ccc([C@H]2Oc3c(cc(/C=C/CO)cc3OC)[C@H]2CO)c1,538.22829,[M+NH4]+,20.0,val,COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1OC1OC(CO)C(O)C(O)C1O
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496212,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12,597.18249,[M+FA]-,20.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12
496213,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12,597.18249,[M+FA]-,60.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12
496214,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12,597.18249,[M+FA]-,15.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12
496215,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12,597.18249,[M+FA]-,20.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(OC(C)=O)C(OC(=O)c3ccccc3)C12
496216,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,597.18249,[M+FA]-,20.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496217,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,597.18249,[M+FA]-,20.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496218,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,597.18249,[M+FA]-,60.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496219,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,597.18249,[M+FA]-,15.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496220,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,597.18249,[M+FA]-,20.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496221,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,570.21811,[M+NH4]+,20.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496222,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,570.21811,[M+NH4]+,20.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
496223,COc1c(O)ccc(C2OCC3(O)C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)OCC23O)c1,570.21811,[M+NH4]+,60.0,val,COc1cc(C2OCC3(O)C(c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23O)ccc1O
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496228,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12O,517.17045,[M+H-2H2O]+,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12O
496229,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12O,517.17045,[M+H-2H2O]+,15.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12O
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496257,COc1c(O)ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)c1,553.19157,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O
496258,COc1c(O)ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)c1,553.19157,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O
496259,COc1c(O)ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)c1,553.19157,[M+H]+,60.0,val,COc1cc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O
496260,COc1c(O)ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)c1,553.19157,[M+H]+,15.0,val,COc1cc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O
496261,COc1c(O)ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)c1,553.19157,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@H]2C[C@@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O
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496338,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12,569.18648,[M+H]+,20.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12
496339,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12,569.18648,[M+H]+,20.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12
496340,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12,569.18648,[M+H]+,60.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12
496341,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12,569.18648,[M+H]+,15.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12
496342,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12,569.18648,[M+H]+,20.0,val,COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(=O)/C=C/c3ccc(O)cc3)C(O)C(O)C12
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496345,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,569.18648,[M+H]+,60.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
496346,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,569.18648,[M+H]+,15.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
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496348,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,569.18648,[M+H]+,60.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
496349,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,569.18648,[M+H]+,15.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
496350,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,569.18648,[M+H]+,20.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
496351,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,586.21303,[M+NH4]+,20.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
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496357,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O,586.21303,[M+NH4]+,15.0,val,COc1cccc2cc3c(c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12)C(C)OC3=O
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496404,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1c(O)c(CC=C(C)C)c(O)cc1)CO2,425.23225,[M+H]+,20.0,val,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
496405,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1c(O)c(CC=C(C)C)c(O)cc1)CO2,425.23225,[M+H]+,60.0,val,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
496406,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1c(O)c(CC=C(C)C)c(O)cc1)CO2,425.23225,[M+H]+,15.0,val,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
496407,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1c(O)c(CC=C(C)C)c(O)cc1)CO2,425.23225,[M+H]+,20.0,val,COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
496408,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,450.23983,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496409,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,450.23983,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496410,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,450.23983,[M-H]-,60.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496411,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,450.23983,[M-H]-,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496412,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,450.23983,[M-H]-,45.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496413,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496414,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496415,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,60.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496416,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,30.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496417,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496418,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,60.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496419,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,30.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496420,CCC(C)C(C(=O)Nc1cc(OCCN2CCOCC2)ccc1)N1Cc2ccccc2C1=O,452.25438,[M+H]+,20.0,val,CCC(C)C(C(=O)Nc1cccc(OCCN2CCOCC2)c1)N1Cc2ccccc2C1=O
496421,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1,545.21596,[M+H]+,20.0,val,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1
496422,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1,545.21596,[M+H]+,20.0,val,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1
496423,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1,545.21596,[M+H]+,60.0,val,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1
496424,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1,545.21596,[M+H]+,15.0,val,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1
496425,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1,545.21596,[M+H]+,20.0,val,O=C(CNC(=O)[C@H](COP(=O)(O)O)NC(=O)CCc1c[nH]c2ccccc12)NCCCCc1ccccc1
496426,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496427,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496428,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,60.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496429,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,15.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496430,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496431,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,60.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496432,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,15.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496433,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,531.2348,[M+FA]-,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496434,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,487.24388,[M+H]+,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496435,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,487.24388,[M+H]+,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496436,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,487.24388,[M+H]+,60.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496437,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,487.24388,[M+H]+,30.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496438,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1,487.24388,[M+H]+,20.0,val,COc1cc(CNC(=O)C2(C)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1
496439,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,20.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496440,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,20.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496441,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,60.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496442,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,30.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496443,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,20.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496444,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,60.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496445,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,30.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496446,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,485.22933,[M-H]-,20.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496447,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,487.24388,[M+H]+,30.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496448,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,487.24388,[M+H]+,30.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496449,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,487.24388,[M+H]+,20.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496450,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,487.24388,[M+H]+,60.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496451,Cc1c2oc(=O)c3c(CCCC3)c2ccc1OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O,487.24388,[M+H]+,30.0,val,Cc1c(OCC(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O)ccc2c3c(c(=O)oc12)CCCC3
496452,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,457.22318,[M-H]-,30.0,val,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
496453,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,457.22318,[M-H]-,30.0,val,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
496454,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,457.22318,[M-H]-,60.0,val,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
496455,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C,457.22318,[M-H]-,30.0,val,CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)O)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
496456,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,493.19985,[M+Cl]-,20.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496457,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,493.19985,[M+Cl]-,15.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496458,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496459,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,60.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496460,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,15.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496461,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496462,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,60.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496463,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,15.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
496464,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1coc(=O)cc1,503.22866,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@H]2O[C@]23[C@@H]2CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]2CC[C@]3(C)[C@H]1c1ccc(=O)oc1
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496581,CC(O)C(CCCCCCCCCCCCCCCCC(=O)O)OC1OC(CO)C(O)C(O)C1O,505.33821,[M-H]-,45.0,val,CC(O)C(CCCCCCCCCCCCCCCCC(=O)O)OC1OC(CO)C(O)C(O)C1O
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496623,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,472.16781,[M-H]-,20.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496624,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,472.16781,[M-H]-,60.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496625,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,472.16781,[M-H]-,20.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496626,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,472.16781,[M-H]-,45.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496627,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,474.18236,[M+H]+,20.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496628,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,474.18236,[M+H]+,20.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496629,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,474.18236,[M+H]+,60.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496630,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,474.18236,[M+H]+,30.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496631,COc1c(OC)cc(CCN2C(=O)c3c(c(-c4ccccc4O)n[nH]3)C2c2ccccc2F)cc1,474.18236,[M+H]+,20.0,val,COc1ccc(CCN2C(=O)c3[nH]nc(-c4ccccc4O)c3C2c2ccccc2F)cc1OC
496632,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O,439.16633,[M-H]-,20.0,val,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O
496633,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O,439.16633,[M-H]-,20.0,val,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O
496634,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O,439.16633,[M-H]-,60.0,val,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O
496635,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O,439.16633,[M-H]-,20.0,val,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O
496636,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O,439.16633,[M-H]-,60.0,val,Cc1cc(O)cc(C)c1C=C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O
496637,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496638,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496639,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,60.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496640,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,30.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496641,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496642,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,30.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496643,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,60.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496644,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,423.17032,[M+H-H2O]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496645,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496646,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496647,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,60.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496648,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,15.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496649,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496650,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,20.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496651,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,60.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496652,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1,441.18088,[M+H]+,15.0,val,COc1ccc(-c2nc(CN3C(=O)C(O)(c4ccc(C)cc4)c4ccccc43)c(C)o2)cc1
496653,O=[N+]([O-])c1ccc(COc2c(OCc3ccc([N+](=O)[O-])cc3)cc3OC4(C=Cc3c2)CCOCC4)cc1,549.15147,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(COc2cc3c(cc2OCc2ccc([N+](=O)[O-])cc2)OC2(C=C3)CCOCC2)cc1
496654,O=[N+]([O-])c1ccc(COc2c(OCc3ccc([N+](=O)[O-])cc3)cc3OC4(C=Cc3c2)CCOCC4)cc1,549.15147,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(COc2cc3c(cc2OCc2ccc([N+](=O)[O-])cc2)OC2(C=C3)CCOCC2)cc1
496655,O=[N+]([O-])c1ccc(COc2c(OCc3ccc([N+](=O)[O-])cc3)cc3OC4(C=Cc3c2)CCOCC4)cc1,549.15147,[M+FA]-,60.0,val,O=[N+]([O-])c1ccc(COc2cc3c(cc2OCc2ccc([N+](=O)[O-])cc2)OC2(C=C3)CCOCC2)cc1
496656,O=[N+]([O-])c1ccc(COc2c(OCc3ccc([N+](=O)[O-])cc3)cc3OC4(C=Cc3c2)CCOCC4)cc1,549.15147,[M+FA]-,15.0,val,O=[N+]([O-])c1ccc(COc2cc3c(cc2OCc2ccc([N+](=O)[O-])cc2)OC2(C=C3)CCOCC2)cc1
496657,O=[N+]([O-])c1ccc(COc2c(OCc3ccc([N+](=O)[O-])cc3)cc3OC4(C=Cc3c2)CCOCC4)cc1,549.15147,[M+FA]-,20.0,val,O=[N+]([O-])c1ccc(COc2cc3c(cc2OCc2ccc([N+](=O)[O-])cc2)OC2(C=C3)CCOCC2)cc1
496658,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496659,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496660,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496661,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496662,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496663,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496664,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496665,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,454.17723,[M-H]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496666,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,490.15391,[M+Cl]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496667,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,490.15391,[M+Cl]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496668,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,490.15391,[M+Cl]-,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496669,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,490.15391,[M+Cl]-,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496670,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,490.15391,[M+Cl]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496671,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496672,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496673,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496674,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496675,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496676,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496677,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496678,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,500.18271,[M+FA]-,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496679,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,456.19178,[M+H]+,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496680,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,456.19178,[M+H]+,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496681,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,456.19178,[M+H]+,60.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496682,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,456.19178,[M+H]+,15.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496683,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21,456.19178,[M+H]+,20.0,val,CC(=O)N1CC(C(=O)N2c3ccccc3CCC2C(=O)Nc2ccccc2)Oc2ccccc21
496684,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,20.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496685,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,20.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496686,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,60.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496687,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,20.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496688,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,45.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496689,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,60.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496690,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,20.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496691,Cc1c(CCN2CCC(=C(c3ccccc3)c3ccc(F)cc3)CC2)c(=O)n2ccsc2n1,460.18534,[M+H]+,45.0,val,Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccccc2)c2ccc(F)cc2)CC1
496692,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496693,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496694,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,60.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496695,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,30.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496696,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496697,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,60.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496698,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,30.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496699,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,457.1769,[M-H]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496700,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,503.18237,[M+FA]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496701,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,503.18237,[M+FA]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496702,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,503.18237,[M+FA]-,60.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496703,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,503.18237,[M+FA]-,15.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496704,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,503.18237,[M+FA]-,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496705,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496706,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496707,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,60.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496708,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,30.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496709,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496710,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,60.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496711,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,30.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496712,COc1cccc(C(=O)Nc2cc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)ccc2)c1,459.19145,[M+H]+,20.0,val,COc1cccc(C(=O)Nc2cccc(OC(=O)C3CC(=O)N(c4cc(C)cc(C)c4)C3)c2)c1
496713,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,20.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496714,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,20.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496715,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,60.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496716,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,20.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496717,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,60.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496718,Cc1nn(C)c2c1c(C(=O)N1CCOC3(CCc4ccccc43)C1)cc(-c1ccccc1)n2,439.21285,[M+H]+,20.0,val,Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOC4(CCc5ccccc54)C3)c12
496719,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,437.1983,[M-H]-,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496720,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,437.1983,[M-H]-,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496721,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,437.1983,[M-H]-,60.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496722,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,437.1983,[M-H]-,30.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496723,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,437.1983,[M-H]-,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496724,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496725,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496726,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,60.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496727,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496728,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,45.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496729,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,60.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496730,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496731,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496732,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496733,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,60.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496734,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,15.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496735,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496736,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496737,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496738,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,60.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496739,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,30.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496740,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496741,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,60.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496742,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,30.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496743,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(C(=O)NC(Cc2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496744,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,439.21285,[M+H]+,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496745,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,439.21285,[M+H]+,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496746,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,439.21285,[M+H]+,60.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496747,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,439.21285,[M+H]+,30.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496748,N#Cc1c(NCC(c2ccccc2)N2CCOCC2)oc(Cc2cccc3ccccc23)n1,439.21285,[M+H]+,20.0,val,N#Cc1nc(Cc2cccc3ccccc23)oc1NCC(c1ccccc1)N1CCOCC1
496749,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496750,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496751,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,45.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496752,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496753,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496754,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,45.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496755,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496756,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,437.1983,[M-H]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496757,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496758,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496759,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496760,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,15.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496761,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496762,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496763,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,15.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496764,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,473.17498,[M+Cl]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496765,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496766,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496767,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496768,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,15.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496769,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,483.20378,[M+FA]-,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496770,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496771,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496772,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496773,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,30.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496774,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496775,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496776,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496777,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496778,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,30.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496779,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496780,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,30.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496781,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,60.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496782,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21,439.21285,[M+H]+,20.0,val,COCCn1cc(CC(=O)NC(c2ccccc2)c2nc3ccccc3[nH]2)c2ccccc21
496783,O=C(O)c1cc2c(cc1)cc(-c1cc(C34CC5CC(CC(C5)C3)C4)c(O)cc1)cc2,397.18092,[M-H]-,20.0,val,O=C(O)c1ccc2cc(-c3ccc(O)c(C45CC6CC(CC(C6)C4)C5)c3)ccc2c1
496784,O=C(O)c1cc2c(cc1)cc(-c1cc(C34CC5CC(CC(C5)C3)C4)c(O)cc1)cc2,397.18092,[M-H]-,20.0,val,O=C(O)c1ccc2cc(-c3ccc(O)c(C45CC6CC(CC(C6)C4)C5)c3)ccc2c1
496785,O=C(O)c1cc2c(cc1)cc(-c1cc(C34CC5CC(CC(C5)C3)C4)c(O)cc1)cc2,397.18092,[M-H]-,60.0,val,O=C(O)c1ccc2cc(-c3ccc(O)c(C45CC6CC(CC(C6)C4)C5)c3)ccc2c1
496786,O=C(O)c1cc2c(cc1)cc(-c1cc(C34CC5CC(CC(C5)C3)C4)c(O)cc1)cc2,397.18092,[M-H]-,20.0,val,O=C(O)c1ccc2cc(-c3ccc(O)c(C45CC6CC(CC(C6)C4)C5)c3)ccc2c1
496787,O=C(O)c1cc2c(cc1)cc(-c1cc(C34CC5CC(CC(C5)C3)C4)c(O)cc1)cc2,397.18092,[M-H]-,75.0,val,O=C(O)c1ccc2cc(-c3ccc(O)c(C45CC6CC(CC(C6)C4)C5)c3)ccc2c1
496788,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496789,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496790,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,60.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496791,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,30.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496792,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496793,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,60.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496794,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,30.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496795,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,477.15549,[M-H]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496796,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,523.16097,[M+FA]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496797,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,523.16097,[M+FA]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496798,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,523.16097,[M+FA]-,60.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496799,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,523.16097,[M+FA]-,15.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496800,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,523.16097,[M+FA]-,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496801,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496802,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496803,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,60.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496804,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,15.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496805,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496806,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,60.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496807,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,15.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496808,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,477.15549,[M-H]-,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496809,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,479.17004,[M+H]+,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496810,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,479.17004,[M+H]+,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496811,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,479.17004,[M+H]+,60.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496812,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,479.17004,[M+H]+,15.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496813,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(cc(O)cc3OC)O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1,479.17004,[M+H]+,20.0,val,COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(O)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccccc1
496814,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,461.15948,[M+H-H2O]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496815,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,461.15948,[M+H-H2O]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496816,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,461.15948,[M+H-H2O]+,60.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496817,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,461.15948,[M+H-H2O]+,15.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496818,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,461.15948,[M+H-H2O]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496819,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,479.17004,[M+H]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496820,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,479.17004,[M+H]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496821,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,479.17004,[M+H]+,60.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496822,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,479.17004,[M+H]+,15.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496823,COc1ccc([C@@]23Oc4c(c(OC)cc(OC)c4)[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1,479.17004,[M+H]+,20.0,val,COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)O)[C@H]3c2ccccc2)cc1
496824,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,477.18312,[M-H]-,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496825,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,477.18312,[M-H]-,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496826,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,477.18312,[M-H]-,60.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496827,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,477.18312,[M-H]-,30.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496828,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,477.18312,[M-H]-,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496829,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,479.19768,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496830,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,479.19768,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496831,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,479.19768,[M+H]+,60.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496832,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,479.19768,[M+H]+,15.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496833,COc1c(OC)cc2c(c1)CCN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C2c1ccc(F)cc1,479.19768,[M+H]+,20.0,val,COc1cc2c(cc1OC)C(c1ccc(F)cc1)N(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CC2
496834,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496835,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496836,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,60.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496837,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,30.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496838,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496839,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496840,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496841,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,30.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496842,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496843,Cc1cnc(CNC(=O)c2c3sc4ccccc4n3c3c(ccc(N4CCCN(C)CC4)n3)c2=O)cn1,514.20197,[M+H]+,20.0,val,Cc1cnc(CNC(=O)c2c(=O)c3ccc(N4CCCN(C)CC4)nc3n3c2sc2ccccc23)cn1
496844,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,423.21904,[M-H]-,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496845,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,423.21904,[M-H]-,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496846,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,423.21904,[M-H]-,45.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496847,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,423.21904,[M-H]-,60.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496848,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,423.21904,[M-H]-,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496849,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,469.22451,[M+FA]-,15.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496850,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,469.22451,[M+FA]-,15.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496851,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,469.22451,[M+FA]-,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496852,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,469.22451,[M+FA]-,60.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496853,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,469.22451,[M+FA]-,15.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496854,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496855,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496856,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,60.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496857,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,30.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496858,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496859,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,30.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496860,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,60.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496861,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21,425.23359,[M+H]+,20.0,val,O=C(NCc1ccccc1)C(C1CCNCC1)n1c(-c2ccccc2)nc2ccccc21
496862,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,491.18554,[M+Cl]-,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496863,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,491.18554,[M+Cl]-,30.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496864,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496865,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496866,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496867,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496868,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496869,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,60.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496870,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496871,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,501.21434,[M+FA]-,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496872,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496873,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496874,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496875,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496876,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496877,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,45.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496878,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,60.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496879,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,457.22342,[M+H]+,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496880,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,474.24996,[M+NH4]+,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496881,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,474.24996,[M+NH4]+,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496882,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,474.24996,[M+NH4]+,20.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496883,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,474.24996,[M+NH4]+,60.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496884,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3cc4c(cc3)N(C)C(=O)CC4)c2)cc1,474.24996,[M+NH4]+,15.0,val,Cc1ccc(CNC(=O)c2cccc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4C)c2)cc1
496885,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,20.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496886,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,20.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496887,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,60.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496888,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,20.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496889,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,45.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496890,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,60.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496891,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,20.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496892,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,547.17691,[M-H]-,45.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496893,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,549.19146,[M+H]+,30.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496894,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,549.19146,[M+H]+,30.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496895,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,549.19146,[M+H]+,20.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496896,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,549.19146,[M+H]+,60.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496897,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1,549.19146,[M+H]+,30.0,val,C=CS(=O)(=O)Nc1ccccc1-c1ccc(C(=O)N2CCC(O)(Cn3cnc4c(cnn4C)c3=O)CC2)cc1
496898,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,543.1508,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496899,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,543.1508,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496900,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,543.1508,[M-H]-,60.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496901,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,543.1508,[M-H]-,30.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496902,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,543.1508,[M-H]-,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496903,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,545.16535,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496904,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,545.16535,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496905,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,545.16535,[M+H]+,60.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496906,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,545.16535,[M+H]+,15.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496907,COc1c(O)ccc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2cc(OC)c(O)cc2)c1,545.16535,[M+H]+,20.0,val,COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@@](O)(C(=O)O)C[C@H]2OC(=O)/C=C/c2ccc(O)c(OC)c2)ccc1O
496908,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,20.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496909,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,20.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496910,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,60.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496911,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,45.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496912,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,60.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496913,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,45.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496914,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,20.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496915,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,20.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496916,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,60.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496917,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,20.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496918,Cc1nc(-c2c(C3CCC3)cc(C)c(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c2)n[nH]1,440.24449,[M+H]+,45.0,val,Cc1nc(-c2cc(C(=O)N3CCC(c4ccc(C#N)cc4)CC3)c(C)cc2C2CCC2)n[nH]1
496919,Nc1c2c(-c3cc(OCc4ccccc4)ccc3)cn(C3CC(CN4CCC4)C3)c2ncn1,440.24449,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1cccc(OCc3ccccc3)c1)cn2C1CC(CN2CCC2)C1
496920,Nc1c2c(-c3cc(OCc4ccccc4)ccc3)cn(C3CC(CN4CCC4)C3)c2ncn1,440.24449,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1cccc(OCc3ccccc3)c1)cn2C1CC(CN2CCC2)C1
496921,Nc1c2c(-c3cc(OCc4ccccc4)ccc3)cn(C3CC(CN4CCC4)C3)c2ncn1,440.24449,[M+H]+,60.0,val,Nc1ncnc2c1c(-c1cccc(OCc3ccccc3)c1)cn2C1CC(CN2CCC2)C1
496922,Nc1c2c(-c3cc(OCc4ccccc4)ccc3)cn(C3CC(CN4CCC4)C3)c2ncn1,440.24449,[M+H]+,20.0,val,Nc1ncnc2c1c(-c1cccc(OCc3ccccc3)c1)cn2C1CC(CN2CCC2)C1
496923,Nc1c2c(-c3cc(OCc4ccccc4)ccc3)cn(C3CC(CN4CCC4)C3)c2ncn1,440.24449,[M+H]+,45.0,val,Nc1ncnc2c1c(-c1cccc(OCc3ccccc3)c1)cn2C1CC(CN2CCC2)C1
496924,CN(C)c1ccc(C(CNc2c(C#N)nc(Cc3cccc4ccccc34)o2)N(C)C)cc1,440.24449,[M+H]+,20.0,val,CN(C)c1ccc(C(CNc2oc(Cc3cccc4ccccc34)nc2C#N)N(C)C)cc1
496925,CN(C)c1ccc(C(CNc2c(C#N)nc(Cc3cccc4ccccc34)o2)N(C)C)cc1,440.24449,[M+H]+,20.0,val,CN(C)c1ccc(C(CNc2oc(Cc3cccc4ccccc34)nc2C#N)N(C)C)cc1
496926,CN(C)c1ccc(C(CNc2c(C#N)nc(Cc3cccc4ccccc34)o2)N(C)C)cc1,440.24449,[M+H]+,60.0,val,CN(C)c1ccc(C(CNc2oc(Cc3cccc4ccccc34)nc2C#N)N(C)C)cc1
496927,CN(C)c1ccc(C(CNc2c(C#N)nc(Cc3cccc4ccccc34)o2)N(C)C)cc1,440.24449,[M+H]+,20.0,val,CN(C)c1ccc(C(CNc2oc(Cc3cccc4ccccc34)nc2C#N)N(C)C)cc1
496928,CN(C)c1ccc(C(CNc2c(C#N)nc(Cc3cccc4ccccc34)o2)N(C)C)cc1,440.24449,[M+H]+,45.0,val,CN(C)c1ccc(C(CNc2oc(Cc3cccc4ccccc34)nc2C#N)N(C)C)cc1
496929,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,544.23139,[M+FA]-,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496930,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,544.23139,[M+FA]-,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496931,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,544.23139,[M+FA]-,60.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496932,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,544.23139,[M+FA]-,15.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496933,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,544.23139,[M+FA]-,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496934,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,500.24046,[M+H]+,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496935,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,500.24046,[M+H]+,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496936,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,500.24046,[M+H]+,60.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496937,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,500.24046,[M+H]+,15.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496938,CCOC(=O)CCN(C(=O)c1cc2c(cc1)n(C)c(CNc1ccc(C(=N)N)cc1)n2)c1ccccn1,500.24046,[M+H]+,20.0,val,CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1
496939,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496940,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496941,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,60.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496942,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,30.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496943,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496944,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,60.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496945,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,30.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496946,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,447.22783,[M+H]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496947,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,469.20977,[M+Na]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496948,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC,469.20977,[M+Na]+,20.0,val,CCOC(=O)[C@@]12CCCC=C1N(Cc1ccc(-c3ccccc3)cc1)C(=O)[C@H]2CC(=O)NC
496949,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,20.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496950,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,20.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496951,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,60.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496952,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,30.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496953,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,20.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496954,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,30.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496955,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,60.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496956,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1,447.22783,[M+H]+,20.0,val,OC(COc1ccc(-c2ccccc2)cc1)CN1CCN(Cc2ccc3c(c2)OCO3)CC1
496957,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496958,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496959,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,60.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496960,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,30.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496961,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496962,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,60.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496963,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,30.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496964,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,457.22451,[M-H]-,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496965,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496966,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496967,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,60.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496968,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,30.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496969,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496970,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,60.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496971,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,30.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496972,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO,459.23907,[M+H]+,20.0,val,O=C(CCCCCCC(=O)N/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)NO
496973,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,444.22927,[M-H]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496974,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,444.22927,[M-H]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496975,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,444.22927,[M-H]-,60.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496976,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,444.22927,[M-H]-,30.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496977,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,444.22927,[M-H]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496978,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,490.23474,[M+FA]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496979,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,490.23474,[M+FA]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496980,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,490.23474,[M+FA]-,60.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496981,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,490.23474,[M+FA]-,15.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496982,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,490.23474,[M+FA]-,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496983,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496984,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496985,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,60.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496986,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,30.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496987,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496988,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,60.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496989,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,30.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496990,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2,446.24382,[M+H]+,20.0,val,COCCN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C12CCCC2
496991,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,20.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496992,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,20.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496993,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,60.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496994,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,30.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496995,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,20.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496996,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,60.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496997,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,30.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496998,CCN(C/C=C/C#CC(C)(C)C)Cc1cc(OCc2cc(-c3cscc3)cs2)ccc1,450.19198,[M+H]+,20.0,val,CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(OCc2cc(-c3ccsc3)cs2)c1
496999,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,500.26427,[M]+,45.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497000,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,500.26427,[M]+,45.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497001,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,500.26427,[M]+,60.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497002,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,500.26427,[M]+,45.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497003,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,501.2721,[M+H]+,20.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497004,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,501.2721,[M+H]+,20.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497005,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,501.2721,[M+H]+,60.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497006,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,501.2721,[M+H]+,20.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497007,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1,501.2721,[M+H]+,45.0,val,C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1
497008,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,515.19227,[M-H]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497009,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,515.19227,[M-H]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497010,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,515.19227,[M-H]-,60.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497011,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,515.19227,[M-H]-,30.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497012,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,515.19227,[M-H]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497013,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,561.19775,[M+FA]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497014,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,561.19775,[M+FA]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497015,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,561.19775,[M+FA]-,60.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497016,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,561.19775,[M+FA]-,30.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497017,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,561.19775,[M+FA]-,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497018,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,517.20682,[M+H]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497019,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,517.20682,[M+H]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497020,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,517.20682,[M+H]+,60.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497021,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,517.20682,[M+H]+,30.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497022,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,517.20682,[M+H]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497023,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,534.23337,[M+NH4]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497024,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,534.23337,[M+NH4]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497025,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,534.23337,[M+NH4]+,60.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497026,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,534.23337,[M+NH4]+,15.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497027,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2cocc2)[C@]5(C)CCC4[C@]13C,534.23337,[M+NH4]+,20.0,val,COC(=O)[C@@H](O)[C@H]1[C@@]2(C)CC3(O)[C@@H](C(=O)[C@H]2O)[C@]24O[C@]25CC(=O)O[C@@H](c2ccoc2)[C@]5(C)CCC4[C@]13C
497028,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497029,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497030,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,60.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497031,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,30.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497032,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497033,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,60.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497034,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,30.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497035,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,522.21805,[M-H]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497036,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,568.22353,[M+FA]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497037,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,568.22353,[M+FA]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497038,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,568.22353,[M+FA]-,15.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497039,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,568.22353,[M+FA]-,60.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497040,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,568.22353,[M+FA]-,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497041,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,524.2326,[M+H]+,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497042,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,524.2326,[M+H]+,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497043,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,524.2326,[M+H]+,60.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497044,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,524.2326,[M+H]+,30.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497045,Cc1c(-c2ccc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)C3(C#N)CC3)C(C)(C)C)cc2)scn1,524.2326,[M+H]+,20.0,val,Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
497046,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,437.23335,[M-H]-,45.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497047,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,437.23335,[M-H]-,45.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497048,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,439.2479,[M+H]+,20.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497049,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,439.2479,[M+H]+,20.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497050,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,439.2479,[M+H]+,60.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497051,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,439.2479,[M+H]+,15.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497052,COc1c(CC=C(C)C)c(OC)c2C[C@H](c3c(O)c(CC=C(C)C)c(O)cc3)COc2c1,439.2479,[M+H]+,20.0,val,COc1cc2c(c(OC)c1CC=C(C)C)C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
497053,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O,519.22564,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O
497054,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O,519.22564,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O
497055,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O,519.22564,[M+H]+,60.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O
497056,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O,519.22564,[M+H]+,30.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O
497057,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O,519.22564,[M+H]+,20.0,val,CCC(C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CN1CCCCC(N)C(=O)O
497058,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,574.22286,[M+FA]-,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497059,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,574.22286,[M+FA]-,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497060,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,574.22286,[M+FA]-,60.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497061,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,574.22286,[M+FA]-,15.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497062,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,574.22286,[M+FA]-,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497063,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497064,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497065,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,60.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497066,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,30.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497067,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497068,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,60.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497069,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,30.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497070,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1,530.23193,[M+H]+,20.0,val,CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
497071,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497072,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497073,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497074,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497075,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497076,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497077,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497078,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497079,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,563.21004,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497080,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,563.21004,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497081,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,563.21004,[M+Cl]-,15.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497082,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,563.21004,[M+Cl]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497083,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,573.23884,[M+FA]-,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497084,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,573.23884,[M+FA]-,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497085,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,573.23884,[M+FA]-,60.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497086,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,573.23884,[M+FA]-,15.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497087,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,573.23884,[M+FA]-,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497088,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497089,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497090,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497091,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497092,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497093,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497094,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497095,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,527.23336,[M-H]-,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497096,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497097,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497098,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,60.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497099,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,30.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497100,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497101,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,60.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497102,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,30.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497103,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12,529.24792,[M+H]+,20.0,val,CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12
497104,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497105,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497106,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497107,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497108,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497109,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497110,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497111,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497112,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497113,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497114,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497115,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,30.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497116,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497117,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,60.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497118,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1,529.24792,[M+H]+,20.0,val,CCS(=O)(=O)N1CCC(C(C)n2c(C)c(C(=O)NCc3c(OC)cc(C)[nH]c3=O)c3ccccc32)CC1
497119,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497120,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497121,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,60.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497122,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,30.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497123,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497124,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,60.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497125,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,30.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497126,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,437.28097,[M-H]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497127,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,473.25764,[M+Cl]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497128,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,473.25764,[M+Cl]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497129,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,473.25764,[M+Cl]-,60.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497130,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,473.25764,[M+Cl]-,15.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497131,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,473.25764,[M+Cl]-,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497132,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497133,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497134,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,60.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497135,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,15.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497136,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497137,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,60.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497138,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,15.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497139,CCC[C@@H](N(NC(=O)c1c(CC)c(OC)ccc1)C(=O)c1cc(C)cc(C)c1)C(C)(C)C,439.29552,[M+H]+,20.0,val,CCC[C@@H](N(NC(=O)c1cccc(OC)c1CC)C(=O)c1cc(C)cc(C)c1)C(C)(C)C
497140,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1,491.32413,[M+H]+,20.0,val,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1
497141,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1,491.32413,[M+H]+,20.0,val,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1
497142,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1,491.32413,[M+H]+,30.0,val,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1
497143,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1,491.32413,[M+H]+,20.0,val,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1
497144,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1,491.32413,[M+H]+,20.0,val,NC1CCC(Nc2nc(Nc3ccc(CN4CCOCC4)cc3)c3ncn(C4CCCC4)c3n2)CC1
497145,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,20.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497146,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,20.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497147,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,60.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497148,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,30.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497149,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,20.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497150,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,60.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497151,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,30.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497152,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1,411.28937,[M+H]+,20.0,val,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
497153,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497154,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,60.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497155,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,30.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497156,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497157,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497158,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497159,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,60.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497160,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,30.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497161,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497162,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,60.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497163,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,30.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497164,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C,411.28937,[M+H]+,20.0,val,C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
497165,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,20.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497166,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,20.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497167,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,60.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497168,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,30.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497169,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,20.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497170,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,60.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497171,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,30.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497172,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,429.29994,[M+H]+,20.0,val,CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
497173,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497174,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497175,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,60.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497176,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,15.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497177,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497178,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,60.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497179,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,15.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497180,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,544.31162,[M+NH4]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497181,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,549.26702,[M+Na]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497182,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,549.26702,[M+Na]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497183,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,549.26702,[M+Na]+,60.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497184,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,549.26702,[M+Na]+,15.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497185,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,549.26702,[M+Na]+,20.0,val,CC(=O)OC1CC2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C
497186,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497187,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497188,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,60.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497189,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497190,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,45.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497191,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497192,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497193,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,60.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497194,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497195,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,45.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497196,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,60.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497197,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497198,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,430.33157,[M+H]+,45.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
497199,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497200,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497201,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,45.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497202,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,60.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497203,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497204,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,45.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497205,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,60.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497206,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O,430.33157,[M+H]+,20.0,val,C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O
497207,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497208,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497209,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497210,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497211,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497212,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497213,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497214,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497215,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497216,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497217,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,75.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497218,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497219,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497220,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1,416.35231,[M+H]+,75.0,val,C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3CN2C1
497221,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497222,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497223,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497224,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497225,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,60.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497226,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,416.35231,[M+H]+,20.0,val,C[C@H]1CC[C@]2(NC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
497227,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,20.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497228,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,20.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497229,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,60.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497230,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,20.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497231,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,45.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497232,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,60.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497233,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,20.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497234,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,388.39378,[M]+,45.0,val,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
497235,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,534.15586,[M-H]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497236,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,534.15586,[M-H]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497237,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,534.15586,[M-H]-,60.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497238,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,534.15586,[M-H]-,15.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497239,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,534.15586,[M-H]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497240,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,570.13254,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497241,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,570.13254,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497242,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,570.13254,[M+Cl]-,60.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497243,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,570.13254,[M+Cl]-,15.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497244,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,570.13254,[M+Cl]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497245,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497246,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497247,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497248,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497249,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497250,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,60.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497251,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,15.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497252,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,580.16134,[M+FA]-,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497253,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,536.17041,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497254,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,536.17041,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497255,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,536.17041,[M+H]+,60.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497256,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,536.17041,[M+H]+,20.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497257,Cc1c(Nc2cc3c(cc2)/C(=C/c2ccc[nH]2)C(=O)N3)cc(NC(=O)Nc2c(F)ccc(C(F)(F)F)c2)cc1,536.17041,[M+H]+,45.0,val,Cc1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1Nc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1
497258,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497259,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497260,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,60.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497261,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,30.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497262,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497263,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,60.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497264,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,30.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497265,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,584.05523,[M-H]-,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497266,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497267,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497268,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,60.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497269,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,30.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497270,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497271,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,60.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497272,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,30.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497273,O=C(O)c1cc(N2CC(O)(c3c(Cl)cc(OCc4c(C5CC5)onc4-c4c(Cl)cccc4Cl)cc3)C2)ncc1,586.06978,[M+H]+,20.0,val,O=C(O)c1ccnc(N2CC(O)(c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3Cl)C2)c1
497274,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,540.05416,[M-H]-,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497275,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,540.05416,[M-H]-,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497276,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,540.05416,[M-H]-,30.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497277,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,586.05964,[M+FA]-,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497278,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,586.05964,[M+FA]-,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497279,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,542.06872,[M+H]+,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497280,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,542.06872,[M+H]+,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497281,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,542.06872,[M+H]+,60.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497282,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,542.06872,[M+H]+,30.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497283,CC(C)c1c(COc2cc(Cl)c(/C=C/c3cc(C(=O)O)ccc3)cc2)c(-c2c(Cl)cccc2Cl)no1,542.06872,[M+H]+,20.0,val,CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(/C=C/c2cccc(C(=O)O)c2)c(Cl)c1
497284,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497285,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497286,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497287,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497288,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497289,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497290,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497291,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497292,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497293,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497294,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497295,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497296,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497297,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,30.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497298,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497299,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497300,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497301,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497302,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497303,Cc1cn(-c2cc(C(F)(F)F)cc(NC(=O)c3cc(Nc4nccc(-c5cnccc5)n4)c(C)cc3)c2)cn1,530.19107,[M+H]+,45.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497304,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497305,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497306,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497307,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497308,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497309,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,528.17652,[M-H]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497310,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,564.15319,[M+Cl]-,15.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497311,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,564.15319,[M+Cl]-,15.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497312,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,564.15319,[M+Cl]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497313,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,574.182,[M+FA]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497314,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,574.182,[M+FA]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497315,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,574.182,[M+FA]-,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497316,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,574.182,[M+FA]-,15.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497317,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,574.182,[M+FA]-,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497318,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497319,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497320,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497321,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497322,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,45.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497323,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,60.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497324,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,20.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497325,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1,530.19107,[M+H]+,45.0,val,Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
497326,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,551.13031,[M-H]-,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497327,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,551.13031,[M-H]-,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497328,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,551.13031,[M-H]-,60.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497329,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,551.13031,[M-H]-,15.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497330,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,551.13031,[M-H]-,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497331,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497332,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497333,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,60.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497334,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,15.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497335,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497336,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,60.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497337,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2c(O)cc(O)cc2)cc1,553.14487,[M+H]+,20.0,val,Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)C(F)F)cc2)C(=O)c2ccc(O)cc2O)cc1
497338,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497339,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497340,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497341,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,15.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497342,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497343,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497344,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,15.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497345,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,517.19692,[M-H]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497346,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,553.17359,[M+Cl]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497347,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,553.17359,[M+Cl]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497348,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,553.17359,[M+Cl]-,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497349,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,553.17359,[M+Cl]-,15.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497350,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,553.17359,[M+Cl]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497351,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497352,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497353,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497354,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,15.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497355,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497356,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497357,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,15.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497358,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,563.2024,[M+FA]-,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497359,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497360,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,20.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497361,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497362,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,45.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497363,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,60.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497364,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12,519.21147,[M+H]+,45.0,val,CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c3ccccc23)c2c(N)nccn12
497365,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,466.17723,[M-H]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497366,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,466.17723,[M-H]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497367,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,466.17723,[M-H]-,60.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497368,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,466.17723,[M-H]-,30.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497369,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,466.17723,[M-H]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497370,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,512.18271,[M+FA]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497371,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,512.18271,[M+FA]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497372,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,512.18271,[M+FA]-,60.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497373,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,512.18271,[M+FA]-,15.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497374,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,512.18271,[M+FA]-,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497375,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,468.19178,[M+H]+,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497376,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,468.19178,[M+H]+,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497377,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,468.19178,[M+H]+,60.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497378,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,468.19178,[M+H]+,30.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497379,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1cc2c(cc1)OCO2,468.19178,[M+H]+,20.0,val,CN1C(=O)c2ccccc2C(C(=O)NCCc2c[nH]c3ccccc23)C1c1ccc2c(c1)OCO2
497380,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1,468.19178,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1
497381,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1,468.19178,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1
497382,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1,468.19178,[M+H]+,60.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1
497383,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1,468.19178,[M+H]+,30.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1
497384,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1,468.19178,[M+H]+,20.0,val,CCOc1ccc(-c2ccc(=O)n(CCNC(=O)C3c4ccccc4Oc4ccccc43)n2)cc1
497385,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,20.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497386,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,20.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497387,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,60.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497388,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,30.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497389,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,20.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497390,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,60.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497391,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,30.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497392,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1,500.22923,[M+H]+,20.0,val,COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1
497393,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,468.2405,[M-H]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497394,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,468.2405,[M-H]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497395,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,468.2405,[M-H]-,60.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497396,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,468.2405,[M-H]-,30.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497397,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,468.2405,[M-H]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497398,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,504.21718,[M+Cl]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497399,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,504.21718,[M+Cl]-,15.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497400,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497401,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497402,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,60.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497403,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,15.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497404,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497405,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,60.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497406,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,15.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497407,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,514.24598,[M+FA]-,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497408,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497409,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497410,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,60.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497411,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,30.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497412,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497413,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,60.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497414,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,30.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497415,CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21,470.25505,[M+H]+,20.0,val,CC1(C)C(=O)N([C@H]2CCc3c(O)cccc32)c2nc(Nc3cccc(CN4CCCC4)c3)ncc21
497416,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
497417,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
497418,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
497419,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
497420,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,45.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
497421,COc1c(O)ccc(-c2c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(=O)c3c(O)cc(O)cc3o2)c1,623.16176,[M-H]-,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
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497492,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
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497494,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,623.16176,[M-H]-,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497495,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
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497498,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,623.16176,[M-H]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497499,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,659.13844,[M+Cl]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497500,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,659.13844,[M+Cl]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497501,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,659.13844,[M+Cl]-,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497502,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,659.13844,[M+Cl]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497503,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,669.16724,[M+FA]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497504,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,669.16724,[M+FA]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497505,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,669.16724,[M+FA]-,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497506,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,669.16724,[M+FA]-,15.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497507,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,669.16724,[M+FA]-,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497508,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497509,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497510,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497511,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,15.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497512,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497513,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,20.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497514,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,15.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497515,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O,625.17631,[M+H]+,60.0,val,COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1O
497516,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C,451.2479,[M+H]+,20.0,val,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C
497517,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C,451.2479,[M+H]+,20.0,val,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C
497518,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C,451.2479,[M+H]+,60.0,val,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C
497519,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C,451.2479,[M+H]+,30.0,val,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C
497520,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C,451.2479,[M+H]+,20.0,val,CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@H]3c3ccoc3)[C@@]21C
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497525,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,537.23864,[M-H]-,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497526,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,537.23864,[M-H]-,60.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497527,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,537.23864,[M-H]-,30.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497528,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,537.23864,[M-H]-,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497529,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,573.21532,[M+Cl]-,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497530,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,573.21532,[M+Cl]-,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497531,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,573.21532,[M+Cl]-,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497532,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,539.25319,[M+H]+,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497533,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,539.25319,[M+H]+,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497534,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,539.25319,[M+H]+,60.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497535,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,539.25319,[M+H]+,30.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497536,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2,539.25319,[M+H]+,20.0,val,COc1c(Nc2ncc(Cl)c(N[C@H]3[C@@H](C(N)=O)[C@@H]4C=C[C@H]3C4)n2)ccc2c1CC[C@@H](N1CCOCC1)CC2
497537,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497538,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497539,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497540,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497541,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497542,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497543,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497544,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497545,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497546,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497547,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,556.21546,[M-H]-,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497548,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,556.21546,[M-H]-,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497549,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,556.21546,[M-H]-,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497550,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,556.21546,[M-H]-,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497551,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,556.21546,[M-H]-,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497552,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,556.21546,[M-H]-,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497553,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,556.21546,[M-H]-,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497554,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,556.21546,[M-H]-,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497555,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,556.21546,[M-H]-,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497556,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497557,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497558,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,558.23002,[M+H]+,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497559,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497560,Cc1c(C2CCNCC2)cc(OC(C)C)c(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497561,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497562,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497563,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497564,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,20.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497565,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497566,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,60.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497567,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1,558.23002,[M+H]+,45.0,val,Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCNCC1
497568,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,20.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497569,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,20.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497570,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,60.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497571,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,30.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497572,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,20.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497573,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,60.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497574,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,30.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497575,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O,499.28026,[M+H]+,20.0,val,C/C1=C\[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)[C@@H](Cc2cnco2)OC1=O
497576,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,20.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497577,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,20.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497578,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,60.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497579,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,30.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497580,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,20.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497581,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,60.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497582,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,30.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497583,c1c(OCCN2CCOCC2)ccc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)c1,470.2901,[M+H]+,20.0,val,c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
497584,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O,538.30106,[M+NH4]+,20.0,val,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O
497585,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O,538.30106,[M+NH4]+,20.0,val,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O
497586,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O,538.30106,[M+NH4]+,60.0,val,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O
497587,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O,538.30106,[M+NH4]+,30.0,val,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O
497588,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O,538.30106,[M+NH4]+,20.0,val,C=C1C(OC(C)=O)C(=O)C2C(C)(C)C(OC(C)=O)CCC2(C)C1CC(OC(C)=O)/C(C)=C/COC(C)=O
497589,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497590,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497591,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497592,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,30.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497593,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497594,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497595,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497596,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497597,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,45.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497598,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497599,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,45.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497600,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497601,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497602,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497603,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,30.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497604,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497605,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497606,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,30.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497607,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,468.32207,[M+H]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497608,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497609,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497610,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497611,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497612,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,45.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497613,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,60.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497614,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,20.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497615,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1,490.30401,[M+Na]+,45.0,val,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
497616,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,20.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497617,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,20.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497618,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,60.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497619,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,30.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497620,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,60.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497621,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O,716.32206,[M-H]-,30.0,val,CC(=O)N(O)CCCC1NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
497622,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497623,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497624,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,75.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497625,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497626,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,75.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497627,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,526.32078,[M-H]-,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497628,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497629,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497630,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497631,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,30.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497632,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497633,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497634,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,30.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497635,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,492.31422,[M+H-2H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497636,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,510.32478,[M+H-H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497637,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,510.32478,[M+H-H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497638,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,510.32478,[M+H-H2O]+,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497639,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,510.32478,[M+H-H2O]+,15.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497640,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,510.32478,[M+H-H2O]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497641,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,528.33534,[M+H]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497642,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,528.33534,[M+H]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497643,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,528.33534,[M+H]+,60.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497644,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,528.33534,[M+H]+,15.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497645,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12,528.33534,[M+H]+,20.0,val,CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)NCCS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
497646,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,20.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497647,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,20.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497648,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,60.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497649,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,60.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497650,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,20.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497651,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,60.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497652,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,503.45442,[M+H]+,45.0,val,c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1
497653,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497654,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497655,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497656,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497657,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,570.37782,[M+Cl]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497658,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497659,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497660,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497661,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,15.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497662,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497663,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497664,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,15.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497665,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,580.40662,[M+FA]-,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497666,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497667,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497668,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497669,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,30.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497670,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497671,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497672,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,30.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497673,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497674,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497675,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497676,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497677,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,30.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497678,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497679,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,60.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497680,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,30.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497681,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O,536.41569,[M+H]+,20.0,val,CC(N)C(O)CCCCCCCCCCCCCCCCC(O)C(C)OC1OC(CO)C(O)C(O)C1O
497682,Cc1cc(-c2c(/C=C/c3ccccc3)cc(-c3cnccc3)cn2)cnc1-c1cnccc1,427.19172,[M+H]+,20.0,val,Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1cccnc1
497683,Cc1cc(-c2c(/C=C/c3ccccc3)cc(-c3cnccc3)cn2)cnc1-c1cnccc1,427.19172,[M+H]+,20.0,val,Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1cccnc1
497684,Cc1cc(-c2c(/C=C/c3ccccc3)cc(-c3cnccc3)cn2)cnc1-c1cnccc1,427.19172,[M+H]+,60.0,val,Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1cccnc1
497685,Cc1cc(-c2c(/C=C/c3ccccc3)cc(-c3cnccc3)cn2)cnc1-c1cnccc1,427.19172,[M+H]+,20.0,val,Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1cccnc1
497686,Cc1cc(-c2c(/C=C/c3ccccc3)cc(-c3cnccc3)cn2)cnc1-c1cnccc1,427.19172,[M+H]+,60.0,val,Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1cccnc1
497687,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,602.13783,[M-H]-,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497688,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,602.13783,[M-H]-,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497689,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,602.13783,[M-H]-,60.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497690,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,602.13783,[M-H]-,30.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497691,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,602.13783,[M-H]-,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497692,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497693,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497694,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,60.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497695,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497696,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,45.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497697,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,60.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497698,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,20.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497699,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(C5CC5)onc3-c3ccccc3OC(F)(F)F)C4)sc2c1,604.15238,[M+H]+,45.0,val,O=C(O)c1cc(F)c2nc(N3[C@@H]4CC[C@H]3CC(OCc3c(-c5ccccc5OC(F)(F)F)noc3C3CC3)C4)sc2c1
497700,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497701,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497702,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,60.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497703,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497704,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,45.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497705,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,60.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497706,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,20.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497707,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2cc(NC(=O)C3CC3)ncc2)c1C,513.19326,[M+H]+,45.0,val,Cc1c(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)ccc(Oc2ccnc(NC(=O)C3CC3)c2)c1C
497708,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497709,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497710,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497711,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,30.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497712,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497713,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497714,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497715,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497716,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,15.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497717,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497718,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497719,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,15.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497720,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497721,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497722,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497723,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497724,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,30.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497725,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497726,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497727,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497728,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497729,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497730,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,30.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497731,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,622.16897,[M-H]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497732,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497733,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497734,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497735,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,15.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497736,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497737,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497738,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,15.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497739,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,668.17445,[M+FA]-,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497740,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497741,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497742,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497743,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,30.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497744,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497745,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,60.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497746,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,30.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497747,CONC(=O)Nc1ccc(-c2c(CN(C)C)c3c(s2)n(Cc2c(F)cccc2F)c(=O)n(-c2nnc(OC)cc2)c3=O)cc1,624.18352,[M+H]+,20.0,val,CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nn2)c(=O)n3Cc2c(F)cccc2F)cc1
497748,CCn1c(=O)c(-c2c(Cl)cc(-c3cncs3)cc2)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21,558.18373,[M+H]+,15.0,val,CCn1c(=O)c(-c2ccc(-c3cncs3)cc2Cl)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21
497749,CCn1c(=O)c(-c2c(Cl)cc(-c3cncs3)cc2)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21,558.18373,[M+H]+,60.0,val,CCn1c(=O)c(-c2ccc(-c3cncs3)cc2Cl)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21
497750,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,601.15628,[M-H]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497751,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,601.15628,[M-H]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497752,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,601.15628,[M-H]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497753,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,601.15628,[M-H]-,30.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497754,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,601.15628,[M-H]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497755,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,647.16176,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497756,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,647.16176,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497757,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,647.16176,[M+FA]-,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497758,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,647.16176,[M+FA]-,15.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497759,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,647.16176,[M+FA]-,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497760,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,620.19738,[M+NH4]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497761,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,620.19738,[M+NH4]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497762,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,620.19738,[M+NH4]+,60.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497763,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,620.19738,[M+NH4]+,15.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497764,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(-c3cc(O)ccc3)cc(O)cc2O)OC=C2C(=O)OCC[C@]21O,620.19738,[M+NH4]+,20.0,val,C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2c(O)cc(O)cc2-c2cccc(O)c2)OC=C2C(=O)OCC[C@]21O
497765,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497766,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497767,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497768,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497769,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497770,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497771,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497772,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497773,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497774,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497775,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497776,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497777,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497778,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497779,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497780,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497781,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497782,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497783,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497784,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497785,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497786,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497787,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497788,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,492.25173,[M-H]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497789,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497790,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497791,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,538.25721,[M+FA]-,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497792,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497793,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497794,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497795,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497796,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497797,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497798,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497799,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497800,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497801,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497802,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,60.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497803,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,20.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497804,Cc1c(Nc2nccc(-c3cnccc3)n2)cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1,494.26628,[M+H]+,45.0,val,Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
497805,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,492.25173,[M-H]-,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497806,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,492.25173,[M-H]-,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497807,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,492.25173,[M-H]-,60.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497808,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,492.25173,[M-H]-,60.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497809,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,538.25721,[M+FA]-,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497810,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,538.25721,[M+FA]-,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497811,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,538.25721,[M+FA]-,60.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497812,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,538.25721,[M+FA]-,15.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497813,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,538.25721,[M+FA]-,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497814,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,494.26628,[M+H]+,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497815,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,494.26628,[M+H]+,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497816,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,494.26628,[M+H]+,60.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497817,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,494.26628,[M+H]+,20.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497818,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12,494.26628,[M+H]+,60.0,val,Cc1nnc(N2CCC(C(=O)NCCc3c[nH]c4ccccc34)CC2)c2nn(-c3ccccc3)c(C)c12
497819,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497820,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497821,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,60.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497822,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497823,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,45.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497824,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,60.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497825,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,508.24665,[M-H]-,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497826,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497827,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497828,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,60.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497829,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,30.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497830,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497831,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,60.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497832,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,30.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497833,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3n[nH]nn3)cc2)C1=O,510.2612,[M+H]+,20.0,val,CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
497834,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497835,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497836,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,30.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497837,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497838,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,30.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497839,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,548.20701,[M-H]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497840,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497841,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497842,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,60.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497843,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,15.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497844,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497845,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,60.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497846,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,15.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497847,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,594.21248,[M+FA]-,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497848,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497849,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497850,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,60.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497851,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,15.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497852,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497853,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,60.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497854,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,15.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497855,Cc1cc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3c(cc(-c4nc(NC5CCOCC5)ncc4Cl)cc3)C2=O)ccc1,550.22156,[M+H]+,20.0,val,Cc1cccc([C@@H](CO)NC(=O)[C@@H](C)N2Cc3ccc(-c4nc(NC5CCOCC5)ncc4Cl)cc3C2=O)c1
497856,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497857,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497858,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,60.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497859,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497860,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,60.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497861,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497862,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497863,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497864,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,60.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497865,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497866,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,60.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497867,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2,428.25841,[M]+,20.0,val,OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2
497868,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1,470.29144,[M+H]+,20.0,val,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1
497869,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1,470.29144,[M+H]+,20.0,val,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1
497870,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1,470.29144,[M+H]+,60.0,val,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1
497871,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1,470.29144,[M+H]+,30.0,val,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1
497872,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1,470.29144,[M+H]+,20.0,val,Cc1ccc(-n2cc(C3=CCN(CC(=O)NC4CCN(Cc5ccccc5)CC4)CC3)cn2)cc1
497873,COc1ccc(S(=O)(=O)N[C@@H](CNc2c(C)c(N3CCC(c4nc5c(cc4)CCCN5)CC3)nc(C)n2)C(=O)O)cc1,594.25041,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N[C@@H](CNc2nc(C)nc(N3CCC(c4ccc5c(n4)NCCC5)CC3)c2C)C(=O)O)cc1
497874,COc1ccc(S(=O)(=O)N[C@@H](CNc2c(C)c(N3CCC(c4nc5c(cc4)CCCN5)CC3)nc(C)n2)C(=O)O)cc1,594.25041,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N[C@@H](CNc2nc(C)nc(N3CCC(c4ccc5c(n4)NCCC5)CC3)c2C)C(=O)O)cc1
497875,COc1ccc(S(=O)(=O)N[C@@H](CNc2c(C)c(N3CCC(c4nc5c(cc4)CCCN5)CC3)nc(C)n2)C(=O)O)cc1,594.25041,[M-H]-,60.0,val,COc1ccc(S(=O)(=O)N[C@@H](CNc2nc(C)nc(N3CCC(c4ccc5c(n4)NCCC5)CC3)c2C)C(=O)O)cc1
497876,COc1ccc(S(=O)(=O)N[C@@H](CNc2c(C)c(N3CCC(c4nc5c(cc4)CCCN5)CC3)nc(C)n2)C(=O)O)cc1,594.25041,[M-H]-,30.0,val,COc1ccc(S(=O)(=O)N[C@@H](CNc2nc(C)nc(N3CCC(c4ccc5c(n4)NCCC5)CC3)c2C)C(=O)O)cc1
497877,COc1ccc(S(=O)(=O)N[C@@H](CNc2c(C)c(N3CCC(c4nc5c(cc4)CCCN5)CC3)nc(C)n2)C(=O)O)cc1,594.25041,[M-H]-,20.0,val,COc1ccc(S(=O)(=O)N[C@@H](CNc2nc(C)nc(N3CCC(c4ccc5c(n4)NCCC5)CC3)c2C)C(=O)O)cc1
497878,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1,479.29043,[M+H]+,20.0,val,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1
497879,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1,479.29043,[M+H]+,20.0,val,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1
497880,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1,479.29043,[M+H]+,60.0,val,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1
497881,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1,479.29043,[M+H]+,30.0,val,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1
497882,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1,479.29043,[M+H]+,20.0,val,CCC1=C(C[C@H]2NCCc3cc(OC)c(OC)cc32)C[C@H]2c3cc(OC)c(OC)cc3CCN2C1
497883,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,20.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497884,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,20.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497885,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,60.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497886,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,20.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497887,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,45.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497888,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,60.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497889,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,20.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497890,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc12,479.29043,[M+H]+,45.0,val,CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC1=NCCc2cc(OC)c(OC)cc21
497891,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,657.20362,[M-H]-,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497892,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,657.20362,[M-H]-,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497893,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,657.20362,[M-H]-,60.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497894,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,657.20362,[M-H]-,30.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497895,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,657.20362,[M-H]-,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497896,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,659.21818,[M+H]+,15.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497897,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,659.21818,[M+H]+,15.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497898,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,659.21818,[M+H]+,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497899,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,659.21818,[M+H]+,60.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497900,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,659.21818,[M+H]+,15.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497901,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497902,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497903,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,60.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497904,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,15.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497905,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497906,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,60.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497907,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,15.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497908,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O,676.24472,[M+NH4]+,20.0,val,COc1cc(C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O
497909,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O,584.30653,[M+NH4]+,20.0,val,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O
497910,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O,584.30653,[M+NH4]+,20.0,val,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O
497911,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O,584.30653,[M+NH4]+,60.0,val,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O
497912,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O,584.30653,[M+NH4]+,15.0,val,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O
497913,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O,584.30653,[M+NH4]+,20.0,val,C=C1CCC2C(C)(COC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)CCCC2(C)C1CCC1=CCOC1=O
497914,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,569.29674,[M-H]-,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497915,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,569.29674,[M-H]-,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497916,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,569.29674,[M-H]-,60.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497917,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,569.29674,[M-H]-,15.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497918,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,569.29674,[M-H]-,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497919,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,571.31129,[M+H]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497920,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,571.31129,[M+H]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497921,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,571.31129,[M+H]+,60.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497922,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,571.31129,[M+H]+,30.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497923,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,571.31129,[M+H]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497924,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497925,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497926,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,60.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497927,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,15.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497928,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497929,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,60.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497930,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,15.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497931,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O,588.33783,[M+NH4]+,20.0,val,C=C1C(OC2OC(CO)C(O)C(O)C2O)CC2C(C)(C)C(O)CCC2(C)C1CC/C(C)=C\COC(=O)CC(=O)O
497932,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497933,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497934,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,60.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497935,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497936,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,60.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497937,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,457.33233,[M-H]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497938,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,503.33781,[M+FA]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497939,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,503.33781,[M+FA]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497940,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,503.33781,[M+FA]-,60.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497941,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,503.33781,[M+FA]-,15.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497942,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12,503.33781,[M+FA]-,20.0,val,CC(=O)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12
497943,Cc1cc(N2C(=O)c3c4c(ccc5C(=O)N(c6c(C)ccc(C)c6)C(=O)c(c54)cc3)C2=O)c(C)cc1,474.15796,[M]-,60.0,val,Cc1ccc(C)c(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)N(c2cc(C)ccc2C)C4=O)c1
497944,Cc1cc(N2C(=O)c3c4c(ccc5C(=O)N(c6c(C)ccc(C)c6)C(=O)c(c54)cc3)C2=O)c(C)cc1,474.15796,[M]-,60.0,val,Cc1ccc(C)c(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)N(c2cc(C)ccc2C)C4=O)c1
497945,Cc1cc(N2C(=O)c3c4c(ccc5C(=O)N(c6c(C)ccc(C)c6)C(=O)c(c54)cc3)C2=O)c(C)cc1,474.15796,[M]-,20.0,val,Cc1ccc(C)c(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)N(c2cc(C)ccc2C)C4=O)c1
497946,Cc1cc(N2C(=O)c3c4c(ccc5C(=O)N(c6c(C)ccc(C)c6)C(=O)c(c54)cc3)C2=O)c(C)cc1,474.15796,[M]-,60.0,val,Cc1ccc(C)c(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)N(c2cc(C)ccc2C)C4=O)c1
497947,Cc1cc(N2C(=O)c3c4c(ccc5C(=O)N(c6c(C)ccc(C)c6)C(=O)c(c54)cc3)C2=O)c(C)cc1,474.15796,[M]-,60.0,val,Cc1ccc(C)c(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)N(c2cc(C)ccc2C)C4=O)c1
497948,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,552.21649,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497949,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,552.21649,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497950,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,552.21649,[M-H]-,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497951,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,552.21649,[M-H]-,30.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497952,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,552.21649,[M-H]-,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497953,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,554.23104,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497954,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,554.23104,[M+H]+,20.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497955,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,554.23104,[M+H]+,60.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497956,CNC(=O)c1nccc(Oc2cc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3cc4c(cc3)nccc4)cc2)c1,554.23104,[M+H]+,45.0,val,CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1
497957,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497958,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497959,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497960,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,30.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497961,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497962,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497963,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,30.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497964,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,563.15589,[M-H]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497965,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,599.13256,[M+Cl]-,15.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497966,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,599.13256,[M+Cl]-,15.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497967,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,599.13256,[M+Cl]-,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497968,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,599.13256,[M+Cl]-,60.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497969,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,599.13256,[M+Cl]-,15.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497970,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497971,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497972,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497973,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,15.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497974,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497975,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,60.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497976,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,15.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497977,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3c(O)cc(O)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,565.17044,[M+H]+,20.0,val,O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)c3ccc(O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
497978,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497979,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497980,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,60.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497981,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,30.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497982,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497983,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497984,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497985,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,60.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497986,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,30.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497987,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497988,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497989,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497990,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,555.19169,[M-H]-,30.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497991,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497992,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497993,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,60.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497994,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,30.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497995,CCOc1c(NC(=O)/C=C/CN(C)C)cc2c(Nc3cc(Cl)c(OCc4ccccn4)cc3)c(C#N)cnc2c1,557.20624,[M+H]+,20.0,val,CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
497996,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
497997,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
497998,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,60.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
497999,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,15.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498000,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498001,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498002,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498003,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,15.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498004,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,625.16261,[M+FA]-,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498005,COc1cc(OC(C)C)c(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498006,COc1cc(OC(C)C)c(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498007,COc1cc(OC(C)C)c(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,60.0,val,COc1ccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498008,COc1cc(OC(C)C)c(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498009,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498010,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498011,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,60.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498012,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498013,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,45.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498014,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,60.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498015,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498016,COc1cc(OC(C)C)c(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,45.0,val,COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498017,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498018,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498019,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,60.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498020,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498021,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,45.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498022,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,60.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498023,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,20.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498024,COc1cc(OC(C)C)c(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)cc1,581.17169,[M+H]+,45.0,val,COc1ccc(C2=N[C@H](c3ccc(Cl)cc3)[C@H](c3ccc(Cl)cc3)N2C(=O)N2CCNC(=O)C2)c(OC(C)C)c1
498025,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,565.23489,[M+Cl]-,15.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498026,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,565.23489,[M+Cl]-,15.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498027,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,575.26369,[M+FA]-,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498028,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,575.26369,[M+FA]-,15.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498029,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,575.26369,[M+FA]-,15.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498030,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498031,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498032,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,60.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498033,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,30.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498034,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498035,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,60.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498036,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,30.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498037,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,531.27277,[M+H]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498038,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,553.25471,[M+Na]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498039,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,553.25471,[M+Na]+,20.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498040,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,553.25471,[M+Na]+,60.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498041,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1,553.25471,[M+Na]+,60.0,val,c1ccc(Cn2cc(CN(Cc3cn(Cc4ccccc4)nn3)Cc3cn(Cc4ccccc4)nn3)nn2)cc1
498042,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,20.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498043,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,20.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498044,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,60.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498045,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,30.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498046,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,20.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498047,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,60.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498048,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,30.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498049,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1,467.23292,[M+H]+,20.0,val,CN(C(=O)C1C2C3C=CC(C4C(=O)N(Cc5ccccc5)C(=O)C34)C12)C1CC(c2ccccc2)C1
498050,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,599.17701,[M-H]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498051,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,599.17701,[M-H]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498052,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,599.17701,[M-H]-,60.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498053,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,599.17701,[M-H]-,30.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498054,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,599.17701,[M-H]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498055,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,645.18249,[M+FA]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498056,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,645.18249,[M+FA]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498057,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,645.18249,[M+FA]-,60.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498058,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,645.18249,[M+FA]-,15.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498059,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,645.18249,[M+FA]-,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498060,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498061,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498062,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,60.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498063,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,15.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498064,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498065,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,60.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498066,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,15.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498067,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,601.19157,[M+H]+,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498068,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,618.21811,[M+NH4]+,30.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498069,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,618.21811,[M+NH4]+,30.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498070,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,618.21811,[M+NH4]+,20.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498071,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,618.21811,[M+NH4]+,60.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498072,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,618.21811,[M+NH4]+,30.0,val,CC1C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12
498073,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498074,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498075,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498076,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498077,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,45.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498078,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498079,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
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498081,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,635.15369,[M+Cl]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498082,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,635.15369,[M+Cl]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
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498086,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498087,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,15.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498088,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498089,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498090,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498091,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498092,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,30.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498093,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498094,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498095,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,30.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498096,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,599.17701,[M-H]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498097,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,635.15369,[M+Cl]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498098,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,635.15369,[M+Cl]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498099,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,635.15369,[M+Cl]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498100,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498101,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498102,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498103,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,645.18249,[M+FA]-,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498104,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498105,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498106,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498107,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,15.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498108,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498109,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,618.21811,[M+NH4]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498110,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,618.21811,[M+NH4]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498111,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,618.21811,[M+NH4]+,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498112,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,618.21811,[M+NH4]+,15.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498113,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O,618.21811,[M+NH4]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O
498114,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498115,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498116,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,60.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498117,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,30.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498118,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,583.18101,[M+H-H2O]+,20.0,val,C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
498119,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3c(ccc(Cl)c3)c(=O)n2Cc2ccccc2)C(C)C)cc1,517.23648,[M+H]+,20.0,val,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
498120,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3c(ccc(Cl)c3)c(=O)n2Cc2ccccc2)C(C)C)cc1,517.23648,[M+H]+,20.0,val,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
498121,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3c(ccc(Cl)c3)c(=O)n2Cc2ccccc2)C(C)C)cc1,517.23648,[M+H]+,60.0,val,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
498122,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3c(ccc(Cl)c3)c(=O)n2Cc2ccccc2)C(C)C)cc1,517.23648,[M+H]+,30.0,val,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
498123,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3c(ccc(Cl)c3)c(=O)n2Cc2ccccc2)C(C)C)cc1,517.23648,[M+H]+,20.0,val,Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
498124,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,20.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498125,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,20.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498126,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,60.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498127,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,20.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498128,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,45.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498129,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,60.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498130,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,20.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498131,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3c(s2)c(N2CCOCC2)nc(-c2c4cn[nH]c4ccc2)n3)CC1,574.25949,[M+H]+,45.0,val,CC(C)=CC(=O)CCC(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1
498132,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498133,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498134,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,60.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498135,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498136,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,45.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498137,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,60.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498138,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498139,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,582.22795,[M-H]-,45.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498140,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498141,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498142,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,60.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498143,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,30.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498144,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498145,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,60.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498146,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,30.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498147,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O,584.2425,[M+H]+,20.0,val,COc1c(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)cc(C(C)(C)C)cc1NS(C)(=O)=O
498148,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3cocc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498149,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3cocc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498150,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3cocc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,60.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498151,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3cocc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,15.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498152,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3cocc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@H](O)[C@]1(C)C2C[C@@H](O)[C@]1(C)C3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498153,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,592.27523,[M+NH4]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498154,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,592.27523,[M+NH4]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498155,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,592.27523,[M+NH4]+,60.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498156,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,592.27523,[M+NH4]+,15.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498157,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,592.27523,[M+NH4]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498158,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,597.23063,[M+Na]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498159,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,597.23063,[M+Na]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498160,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,597.23063,[M+Na]+,60.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498161,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,597.23063,[M+Na]+,30.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498162,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4cocc4)[C@]1(C)CCC32,597.23063,[M+Na]+,20.0,val,CCC(=O)O[C@H]1C(C)(C)[C@H]([C@@H](O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(O)[C@H]1O[C@]13C1CC(=O)O[C@@H](c4ccoc4)[C@]1(C)CCC32
498163,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,573.23414,[M-H]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498164,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,573.23414,[M-H]-,30.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498165,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498166,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498167,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,60.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498168,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,15.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
498169,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321,619.23961,[M+FA]-,20.0,val,CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](OC(C)=O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
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498248,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,485.32725,[M-H]-,20.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498249,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,485.32725,[M-H]-,60.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498250,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,485.32725,[M-H]-,20.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498251,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,485.32725,[M-H]-,60.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498252,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,531.33273,[M+FA]-,20.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498253,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,531.33273,[M+FA]-,20.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498254,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,531.33273,[M+FA]-,60.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498255,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12,531.33273,[M+FA]-,60.0,val,C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@]5(C)C(CC[C@]43C)C(C)(C)[C@@H](O)[C@@H]5C(=O)O)C12
498256,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O,487.3418,[M+H]+,20.0,val,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
498257,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O,487.3418,[M+H]+,20.0,val,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
498258,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O,487.3418,[M+H]+,60.0,val,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
498259,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O,487.3418,[M+H]+,30.0,val,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
498260,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O,487.3418,[M+H]+,20.0,val,CC(CC(O)C(O)C(C)(C)O)C1=C2C=CC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1=O
498261,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498262,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498263,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,15.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498264,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498265,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,15.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498266,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,579.31747,[M+FA]-,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498267,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,535.32654,[M+H]+,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498268,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,535.32654,[M+H]+,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498269,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,535.32654,[M+H]+,60.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498270,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,535.32654,[M+H]+,15.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498271,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O,535.32654,[M+H]+,20.0,val,CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)O[C@@H](C)[C@@H]1O
498272,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498273,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498274,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,60.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498275,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498276,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,45.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498277,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,60.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498278,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498279,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,533.31199,[M-H]-,45.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498280,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498281,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498282,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,60.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498283,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,15.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498284,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,20.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498285,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,60.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
498286,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1,579.31747,[M+FA]-,15.0,val,CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1
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498368,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,455.35198,[M+H-2H2O]+,20.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498369,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,455.35198,[M+H-2H2O]+,60.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498370,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,455.35198,[M+H-2H2O]+,30.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498371,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,455.35198,[M+H-2H2O]+,20.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498372,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498373,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498374,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,491.3731,[M+H]+,60.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498375,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,491.3731,[M+H]+,15.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498376,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1
498377,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,455.35198,[M+H-2H2O]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498378,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,455.35198,[M+H-2H2O]+,60.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498379,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,455.35198,[M+H-2H2O]+,30.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498380,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,455.35198,[M+H-2H2O]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498381,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,473.36254,[M+H-H2O]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498382,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,473.36254,[M+H-H2O]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498383,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,473.36254,[M+H-H2O]+,60.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498384,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,473.36254,[M+H-H2O]+,15.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498385,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,473.36254,[M+H-H2O]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498386,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498387,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498388,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,491.3731,[M+H]+,60.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498389,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,491.3731,[M+H]+,30.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498390,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1,491.3731,[M+H]+,20.0,val,CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@@]56C[C@@]46CC[C@]23C)O1
498391,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,557.14532,[M-H]-,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498392,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,557.14532,[M-H]-,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498393,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,557.14532,[M-H]-,60.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498394,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,557.14532,[M-H]-,30.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498395,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,557.14532,[M-H]-,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498396,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498397,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498398,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,60.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498399,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,15.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498400,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498401,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,60.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498402,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,15.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498403,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)c3c(cc2O)OC(c2ccc(O)cc2)C(O)C3)cc1,559.15987,[M+H]+,20.0,val,COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2c2c(O)cc3c(c2O)CC(O)C(c2ccc(O)cc2)O3)cc1
498404,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,522.20344,[M-H]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498405,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,522.20344,[M-H]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498406,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,522.20344,[M-H]-,60.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498407,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,522.20344,[M-H]-,30.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498408,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,522.20344,[M-H]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498409,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498410,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498411,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,60.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498412,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,15.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498413,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498414,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,60.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498415,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,15.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498416,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,568.20892,[M+FA]-,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498417,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498418,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498419,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,60.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498420,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,30.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498421,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498422,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,60.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498423,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,30.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498424,COc1c(COc2ccc(NC(C)=O)cc2)cc(C2Nc3c(C(=O)N2Cc2ccccc2)c(O)ccc3)cc1,524.218,[M+H]+,20.0,val,COc1ccc(C2Nc3cccc(O)c3C(=O)N2Cc2ccccc2)cc1COc1ccc(NC(C)=O)cc1
498425,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498426,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498427,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,60.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498428,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,15.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498429,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498430,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,60.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498431,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,15.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498432,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,539.21876,[M+FA]-,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498433,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498434,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498435,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,60.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498436,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,15.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498437,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498438,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498439,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498440,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,60.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498441,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,15.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498442,Cc1cc(C)c([C@@H](NC(=O)Cc2cc3c(cc2)oc([C@@H](O)c2c(C)onc2C)c3)c2ccccc2)cc1,495.22783,[M+H]+,20.0,val,Cc1ccc([C@@H](NC(=O)Cc2ccc3oc([C@@H](O)c4c(C)noc4C)cc3c2)c2ccccc2)c(C)c1
498443,COc1ccc(C(CC(=O)N2CCCC2)c2c3oc(=O)cc(-c4ccccc4)c3c(OC)cc2OC)cc1,514.22241,[M+H]+,20.0,val,COc1ccc(C(CC(=O)N2CCCC2)c2c(OC)cc(OC)c3c(-c4ccccc4)cc(=O)oc23)cc1
498444,COc1ccc(C(CC(=O)N2CCCC2)c2c3oc(=O)cc(-c4ccccc4)c3c(OC)cc2OC)cc1,514.22241,[M+H]+,20.0,val,COc1ccc(C(CC(=O)N2CCCC2)c2c(OC)cc(OC)c3c(-c4ccccc4)cc(=O)oc23)cc1
498445,COc1ccc(C(CC(=O)N2CCCC2)c2c3oc(=O)cc(-c4ccccc4)c3c(OC)cc2OC)cc1,514.22241,[M+H]+,60.0,val,COc1ccc(C(CC(=O)N2CCCC2)c2c(OC)cc(OC)c3c(-c4ccccc4)cc(=O)oc23)cc1
498446,COc1ccc(C(CC(=O)N2CCCC2)c2c3oc(=O)cc(-c4ccccc4)c3c(OC)cc2OC)cc1,514.22241,[M+H]+,15.0,val,COc1ccc(C(CC(=O)N2CCCC2)c2c(OC)cc(OC)c3c(-c4ccccc4)cc(=O)oc23)cc1
498447,COc1ccc(C(CC(=O)N2CCCC2)c2c3oc(=O)cc(-c4ccccc4)c3c(OC)cc2OC)cc1,514.22241,[M+H]+,20.0,val,COc1ccc(C(CC(=O)N2CCCC2)c2c(OC)cc(OC)c3c(-c4ccccc4)cc(=O)oc23)cc1
498448,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,20.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498449,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,20.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498450,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,60.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498451,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,15.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498452,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,20.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498453,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,60.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498454,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,15.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498455,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13,542.31123,[M+NH4]+,20.0,val,CC(=O)OC1C(OC(=O)c2ccccc2)C2C(C)(C)CCC(OC(C)=O)C2(C)C23CCC(C)(C2)C(=O)CC13
498456,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,634.2869,[M+FA]-,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498457,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,634.2869,[M+FA]-,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498458,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,634.2869,[M+FA]-,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498459,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498460,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498461,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,60.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498462,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498463,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,60.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498464,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,590.29597,[M+H]+,20.0,val,COC[C@]12CN(C)C3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC
498465,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498466,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498467,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498468,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,45.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498469,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498470,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,658.40327,[M-H]-,45.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498471,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,694.37994,[M+Cl]-,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498472,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,694.37994,[M+Cl]-,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498473,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,694.37994,[M+Cl]-,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498474,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498475,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498476,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498477,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,30.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498478,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498479,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498480,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,30.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498481,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,660.41782,[M+H]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498482,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,677.44437,[M+NH4]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498483,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,677.44437,[M+NH4]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498484,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,677.44437,[M+NH4]+,60.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498485,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,677.44437,[M+NH4]+,30.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498486,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C,677.44437,[M+NH4]+,20.0,val,CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(CC(C)CO)C(O)CC(=O)O)C(C)C)C(C)C
498487,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498488,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498489,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498490,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498491,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,45.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498492,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498493,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498494,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,604.19773,[M-H]-,45.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498495,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,650.20321,[M+FA]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498496,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,650.20321,[M+FA]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498497,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,650.20321,[M+FA]-,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498498,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,650.20321,[M+FA]-,15.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498499,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,650.20321,[M+FA]-,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498500,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498501,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498502,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498503,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498504,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498505,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498506,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498507,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498508,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498509,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498510,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498511,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498512,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498513,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498514,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498515,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498516,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498517,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498518,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498519,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498520,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498521,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,60.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498522,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,30.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498523,CCOc1ccc(-n2c([C@@H](C)N(Cc3cnccc3)C(=O)Cc3cc(C(F)(F)F)c(F)cc3)nc3c(cccn3)c2=O)cc1,606.21228,[M+H]+,20.0,val,CCOc1ccc(-n2c([C@@H](C)N(Cc3cccnc3)C(=O)Cc3ccc(F)c(C(F)(F)F)c3)nc3ncccc3c2=O)cc1
498524,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498525,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498526,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,15.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498527,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498528,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498529,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498530,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498531,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498532,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498533,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498534,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498535,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498536,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498537,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498538,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498539,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498540,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498541,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498542,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498543,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498544,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,15.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498545,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498546,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498547,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2cccc3ccccc23)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498548,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498549,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498550,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498551,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498552,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498553,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,60.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498554,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,30.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498555,COc1c([C@@H](c2ccccc2)[C@@](O)(CCN(C)C)c2c3ccccc3ccc2)cc2cc(Br)ccc2n1,555.16417,[M+H]+,20.0,val,COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
498556,COc1c(-c2cc(C(=O)NC3(C(=O)O)C4CC5CC(C4)CC3C5)nn2-c2c3ccc(Cl)cc3ncc2)c(OC)ccc1,587.20557,[M+H]+,20.0,val,COc1cccc(OC)c1-c1cc(C(=O)NC2(C(=O)O)C3CC4CC(C3)CC2C4)nn1-c1ccnc2cc(Cl)ccc12
498557,COc1c(-c2cc(C(=O)NC3(C(=O)O)C4CC5CC(C4)CC3C5)nn2-c2c3ccc(Cl)cc3ncc2)c(OC)ccc1,587.20557,[M+H]+,20.0,val,COc1cccc(OC)c1-c1cc(C(=O)NC2(C(=O)O)C3CC4CC(C3)CC2C4)nn1-c1ccnc2cc(Cl)ccc12
498558,COc1c(-c2cc(C(=O)NC3(C(=O)O)C4CC5CC(C4)CC3C5)nn2-c2c3ccc(Cl)cc3ncc2)c(OC)ccc1,587.20557,[M+H]+,60.0,val,COc1cccc(OC)c1-c1cc(C(=O)NC2(C(=O)O)C3CC4CC(C3)CC2C4)nn1-c1ccnc2cc(Cl)ccc12
498559,COc1c(-c2cc(C(=O)NC3(C(=O)O)C4CC5CC(C4)CC3C5)nn2-c2c3ccc(Cl)cc3ncc2)c(OC)ccc1,587.20557,[M+H]+,30.0,val,COc1cccc(OC)c1-c1cc(C(=O)NC2(C(=O)O)C3CC4CC(C3)CC2C4)nn1-c1ccnc2cc(Cl)ccc12
498560,COc1c(-c2cc(C(=O)NC3(C(=O)O)C4CC5CC(C4)CC3C5)nn2-c2c3ccc(Cl)cc3ncc2)c(OC)ccc1,587.20557,[M+H]+,20.0,val,COc1cccc(OC)c1-c1cc(C(=O)NC2(C(=O)O)C3CC4CC(C3)CC2C4)nn1-c1ccnc2cc(Cl)ccc12
498561,O=C(O)c1ccccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3CCCc2c13)CCC4,491.23292,[M]+,20.0,val,O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3
498562,O=C(O)c1ccccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3CCCc2c13)CCC4,491.23292,[M]+,20.0,val,O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3
498563,O=C(O)c1ccccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3CCCc2c13)CCC4,491.23292,[M]+,60.0,val,O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3
498564,O=C(O)c1ccccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3CCCc2c13)CCC4,491.23292,[M]+,20.0,val,O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3
498565,O=C(O)c1ccccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3CCCc2c13)CCC4,491.23292,[M]+,75.0,val,O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3
498566,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,20.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498567,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,20.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498568,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,60.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498569,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,30.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498570,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,20.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498571,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,60.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498572,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,30.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498573,CCN1CCN(Cc2c(C(F)(F)F)cc(NC(=O)c3cc(/C=C/c4cnc5[nH]ccc5c4OC)c(C)cc3)cc2)CC1,578.27374,[M+H]+,20.0,val,CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(/C=C/c4cnc5[nH]ccc5c4OC)c3)cc2C(F)(F)F)CC1
498574,COc1cccc2c1C(=O)c1c(O)c3c(C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]3C[C@H]4[C@H](O[C@@H]5[C@@H](OC)OCCN54)[C@H](C)O3)c(O)c1C2=O,642.21812,[M+H]+,20.0,val,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]2[C@H](O[C@@H]3[C@@H](OC)OCCN32)[C@H](C)O1
498575,COc1cccc2c1C(=O)c1c(O)c3c(C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]3C[C@H]4[C@H](O[C@@H]5[C@@H](OC)OCCN54)[C@H](C)O3)c(O)c1C2=O,642.21812,[M+H]+,20.0,val,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]2[C@H](O[C@@H]3[C@@H](OC)OCCN32)[C@H](C)O1
498576,COc1cccc2c1C(=O)c1c(O)c3c(C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]3C[C@H]4[C@H](O[C@@H]5[C@@H](OC)OCCN54)[C@H](C)O3)c(O)c1C2=O,642.21812,[M+H]+,60.0,val,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]2[C@H](O[C@@H]3[C@@H](OC)OCCN32)[C@H](C)O1
498577,COc1cccc2c1C(=O)c1c(O)c3c(C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]3C[C@H]4[C@H](O[C@@H]5[C@@H](OC)OCCN54)[C@H](C)O3)c(O)c1C2=O,642.21812,[M+H]+,15.0,val,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]2[C@H](O[C@@H]3[C@@H](OC)OCCN32)[C@H](C)O1
498578,COc1cccc2c1C(=O)c1c(O)c3c(C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]3C[C@H]4[C@H](O[C@@H]5[C@@H](OC)OCCN54)[C@H](C)O3)c(O)c1C2=O,642.21812,[M+H]+,20.0,val,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]2[C@H](O[C@@H]3[C@@H](OC)OCCN32)[C@H](C)O1
498579,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,570.27219,[M-H]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498580,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,570.27219,[M-H]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498581,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,570.27219,[M-H]-,60.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498582,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,570.27219,[M-H]-,30.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498583,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,570.27219,[M-H]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498584,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498585,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498586,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,60.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498587,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,15.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498588,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498589,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,60.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498590,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,15.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498591,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,616.27767,[M+FA]-,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498592,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498593,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498594,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,60.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498595,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,30.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498596,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498597,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,60.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498598,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,30.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498599,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,572.28674,[M+H]+,20.0,val,NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1
498600,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,605.24393,[M-H]-,20.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498601,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,605.24393,[M-H]-,20.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498602,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,605.24393,[M-H]-,60.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498603,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,605.24393,[M-H]-,60.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498604,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,607.25848,[M+H]+,20.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498605,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,607.25848,[M+H]+,20.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498606,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,607.25848,[M+H]+,60.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498607,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,607.25848,[M+H]+,30.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498608,COc1cc2c(cc1)-c1c(C3CCCCC3)c3c4cc(cc3)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C(=O)C(=C2)Cn14,607.25848,[M+H]+,20.0,val,COc1ccc2c(c1)C=C1Cn3c-2c(C2CCCCC2)c2ccc(cc23)C(=O)NS(=O)(=O)N(C)CCOCCN(C)C1=O
498609,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,652.214,[M-H]-,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498610,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,652.214,[M-H]-,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498611,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,652.214,[M-H]-,60.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498612,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,652.214,[M-H]-,30.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498613,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,652.214,[M-H]-,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498614,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,654.22856,[M+H]+,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498615,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,654.22856,[M+H]+,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498616,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,654.22856,[M+H]+,60.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498617,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,654.22856,[M+H]+,30.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498618,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5c6c(c(Br)[nH]c6ccc5)C[C@H]4N(C)C3)(C(C)C)C(=O)N12,654.22856,[M+H]+,20.0,val,CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12
498619,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,647.27696,[M-H]-,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498620,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,647.27696,[M-H]-,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498621,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,649.29151,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498622,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,649.29151,[M+H]+,20.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498623,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,649.29151,[M+H]+,60.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498624,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,649.29151,[M+H]+,30.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498625,CCOc1c(Nc2ncc3c(n2)N(S(C)(=O)=O)c2ccccc2C(=O)N3C)ccc(C(=O)N2CCC(N3CCN(C)CC3)CC2)c1,649.29151,[M+H]+,30.0,val,CCOc1cc(C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2c(n1)N(S(C)(=O)=O)c1ccccc1C(=O)N2C
498626,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498627,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498628,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,60.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498629,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,15.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498630,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498631,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,60.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498632,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,15.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498633,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,725.22984,[M+FA]-,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498634,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,698.26546,[M+NH4]+,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498635,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,698.26546,[M+NH4]+,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498636,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,698.26546,[M+NH4]+,60.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498637,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,698.26546,[M+NH4]+,15.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498638,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1,698.26546,[M+NH4]+,20.0,val,CC(=O)O[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)O[C@@H](C)[C@@H]1OC(=O)/C=C/c1ccccc1
498639,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,641.26506,[M-H]-,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498640,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,641.26506,[M-H]-,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498641,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,641.26506,[M-H]-,60.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498642,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,641.26506,[M-H]-,30.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498643,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,641.26506,[M-H]-,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498644,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498645,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498646,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,60.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498647,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,30.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498648,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,20.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498649,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cc(OC)c(OC)cc2)n(C)c(=O)n3C)c1,643.27961,[M+H]+,60.0,val,CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)n(C)c(=O)n3C)c1
498650,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3c2cc(C(F)(F)F)cc3)CC1,592.31791,[M+H]+,20.0,val,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
498651,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3c2cc(C(F)(F)F)cc3)CC1,592.31791,[M+H]+,20.0,val,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
498652,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3c2cc(C(F)(F)F)cc3)CC1,592.31791,[M+H]+,60.0,val,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
498653,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3c2cc(C(F)(F)F)cc3)CC1,592.31791,[M+H]+,20.0,val,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
498654,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3c2cc(C(F)(F)F)cc3)CC1,592.31791,[M+H]+,45.0,val,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
498655,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,20.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498656,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,20.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498657,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,60.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498658,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,20.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498659,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498660,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,60.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498661,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,20.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498662,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498663,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498664,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498665,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,60.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498666,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498667,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,60.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498668,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,585.31704,[M+H]+,45.0,val,CCN1C[C@]2(OC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC
498669,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C,535.27037,[M+H]+,20.0,val,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C
498670,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C,535.27037,[M+H]+,20.0,val,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C
498671,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C,535.27037,[M+H]+,60.0,val,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C
498672,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C,535.27037,[M+H]+,60.0,val,C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)CC(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)O)C4=N3)C(CC)=C1C
498673,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498674,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498675,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498676,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498677,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498678,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O
498679,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O
498680,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O
498681,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O,559.26028,[M+H]+,15.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O
498682,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)O
498683,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498684,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498685,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498686,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498687,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498688,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498689,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498690,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498691,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498692,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498693,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498694,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498695,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498696,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498697,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498698,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498699,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498700,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498701,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498702,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498703,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,557.24572,[M-H]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498704,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,593.2224,[M+Cl]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498705,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,593.2224,[M+Cl]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498706,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,593.2224,[M+Cl]-,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498707,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,593.2224,[M+Cl]-,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498708,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498709,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498710,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498711,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498712,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498713,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498714,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498715,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498716,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498717,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498718,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498719,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498720,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498721,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,60.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498722,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,30.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498723,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O,559.26028,[M+H]+,20.0,val,CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O
498724,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,20.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498725,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,20.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498726,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,60.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498727,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,20.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498728,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,45.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498729,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,60.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498730,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,20.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498731,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21,506.2802,[M+H]+,45.0,val,CC(C)NCC(O)COC(Cn1c2ccccc2c2ccccc21)Cn1c2ccccc2c2ccccc21
498732,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498733,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498734,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,60.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498735,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498736,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,45.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498737,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,60.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498738,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498739,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,612.24637,[M-H]-,45.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498740,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498741,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498742,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,60.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498743,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,30.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498744,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498745,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,60.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498746,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,30.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498747,O=C1CCC(N2C(=O)c3c(C2=O)c(OCCCCCOc2ccc(CC(=O)Nc4n[nH]c(C5CCC5)c4)cc2)ccc3)C(=O)N1,614.26092,[M+H]+,20.0,val,O=C1CCC(N2C(=O)c3cccc(OCCCCCOc4ccc(CC(=O)Nc5cc(C6CCC6)[nH]n5)cc4)c3C2=O)C(=O)N1
498748,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498749,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498750,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498751,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498752,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,45.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498753,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498754,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498755,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498756,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498757,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,595.24968,[M-H]-,45.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498758,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc(C3C(=O)N(C)CCN3C)cc2)n1
498759,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc(C3C(=O)N(C)CCN3C)cc2)n1
498760,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc(C3C(=O)N(C)CCN3C)cc2)n1
498761,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc(C3C(=O)N(C)CCN3C)cc2)n1
498762,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc(C3C(=O)N(C)CCN3C)cc2)n1
498763,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498764,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498765,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498766,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498767,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498768,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498769,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498770,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@@H]3C(=O)N(C)CCN3C)cc2)n1
498771,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498772,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498773,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498774,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498775,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498776,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,60.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498777,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,30.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498778,Cc1c(-c2cn(C)c(=O)c(Nc3ccc([C@H]4C(=O)N(C)CCN4C)cc3)n2)cccc1NC(=O)c1cc2c(CCCC2)s1,597.26424,[M+H]+,20.0,val,Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1cn(C)c(=O)c(Nc2ccc([C@H]3C(=O)N(C)CCN3C)cc2)n1
498779,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,20.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498780,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,20.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498781,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,60.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498782,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,15.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498783,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,20.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498784,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,60.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498785,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,15.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498786,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12,614.29597,[M+NH4]+,20.0,val,CC(=O)OC1/C(C)=C/C(=O)C(OC(C)=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(=O)c3ccccc3)C12
498787,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498788,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498789,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,45.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498790,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498791,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498792,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498793,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,45.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498794,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,659.23453,[M-H]-,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498795,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498796,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498797,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498798,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,15.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498799,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498800,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,20.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498801,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,15.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
498802,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,661.24908,[M+H]+,60.0,val,COc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
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498847,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,619.36001,[M-H]-,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498848,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,619.36001,[M-H]-,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498849,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,619.36001,[M-H]-,60.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498850,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,619.36001,[M-H]-,30.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498851,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,619.36001,[M-H]-,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498852,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498853,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498854,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,60.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498855,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,30.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498856,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498857,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,60.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498858,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,30.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498859,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C,621.37456,[M+H]+,20.0,val,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)[C@H](CC(=O)O)NC(=O)CC[C@H](N)C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
498860,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,20.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498861,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,20.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498862,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,60.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498863,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,20.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498864,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,60.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498865,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,527.3742,[M-H]-,20.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498866,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,563.35088,[M+Cl]-,15.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498867,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,563.35088,[M+Cl]-,15.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498868,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C,563.35088,[M+Cl]-,15.0,val,C=C(CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C
498869,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,578.27728,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498870,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,578.27728,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498871,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,578.27728,[M-H]-,60.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498872,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,578.27728,[M-H]-,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498873,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,578.27728,[M-H]-,45.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498874,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,624.28276,[M+FA]-,15.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498875,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,624.28276,[M+FA]-,15.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498876,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,624.28276,[M+FA]-,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498877,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,624.28276,[M+FA]-,60.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498878,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,624.28276,[M+FA]-,15.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498879,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,580.29183,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498880,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,580.29183,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498881,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,580.29183,[M+H]+,60.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498882,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,580.29183,[M+H]+,30.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498883,Cc1c(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cccc1NC(=O)c1ccc(C(C)(C)C)cc1,580.29183,[M+H]+,20.0,val,Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cc2)n1
498884,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498885,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498886,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498887,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,30.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498888,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498889,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498890,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,30.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498891,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,669.21888,[M-H]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498892,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,715.22436,[M+FA]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498893,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,715.22436,[M+FA]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
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498895,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,715.22436,[M+FA]-,15.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498896,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,715.22436,[M+FA]-,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498897,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498898,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498899,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498900,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,15.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498901,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498902,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,60.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498903,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,15.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498904,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1,688.25998,[M+NH4]+,20.0,val,COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\COC(=O)/C=C/c2ccccc2)C1CC(=O)OCCc1ccc(O)cc1
498905,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,626.30964,[M-H]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498906,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498907,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498908,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498909,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498910,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498911,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498912,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498913,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498914,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498915,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498916,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498917,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498918,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498919,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498920,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498921,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498922,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498923,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498924,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498925,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498926,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498927,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498928,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498929,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498930,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498931,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498932,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498933,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,626.30964,[M-H]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498934,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,626.30964,[M-H]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498935,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,626.30964,[M-H]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498936,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498937,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498938,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498939,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498940,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498941,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498942,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498943,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498944,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498945,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498946,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498947,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498948,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,662.28632,[M+Cl]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498949,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498950,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498951,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498952,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498953,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498954,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498955,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498956,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,672.31512,[M+FA]-,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498957,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498958,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498959,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498960,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498961,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,15.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498962,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498963,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498964,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498965,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498966,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498967,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,60.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498968,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,30.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498969,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3c(ccc(C(=O)N(CCC(=O)OCC)c4ccccn4)c3)n2C)cc1,628.32419,[M+H]+,20.0,val,CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1
498970,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,594.30724,[M-H]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498971,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,594.30724,[M-H]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498972,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,594.30724,[M-H]-,60.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498973,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,594.30724,[M-H]-,45.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498974,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,630.28392,[M+Cl]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498975,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,630.28392,[M+Cl]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498976,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,630.28392,[M+Cl]-,60.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498977,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,640.31272,[M+FA]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498978,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,640.31272,[M+FA]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498979,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,640.31272,[M+FA]-,60.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498980,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,640.31272,[M+FA]-,15.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498981,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,640.31272,[M+FA]-,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498982,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,596.32179,[M+H]+,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498983,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,596.32179,[M+H]+,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498984,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,596.32179,[M+H]+,60.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498985,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,596.32179,[M+H]+,15.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498986,O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)cc1,596.32179,[M+H]+,20.0,val,O=C(O)c1ccc(OCCCc2ccc(OCCCCOC3CCCCC3)cc2)c(C(=O)N[C@H]2CCC[C@H](C(=O)O)C2)c1
498987,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,20.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
498988,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,20.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
498989,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,60.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
498990,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,15.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
498991,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,20.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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499021,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,15.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499022,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,20.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499023,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,60.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499024,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,20.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499025,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,787.26662,[M+FA]-,15.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499026,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,20.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499027,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,20.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499028,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,60.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499029,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,15.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499030,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,20.0,val,COc1cc(C2OCC3C(c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OCC23)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499031,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,15.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499032,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,15.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499033,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,20.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499034,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,60.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499035,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,760.30224,[M+NH4]+,15.0,val,COc1cc([C@H]2OC[C@@H]3[C@@H]2CO[C@H]3c2cc(OC)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
499036,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,20.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499037,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,20.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499038,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,60.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499039,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,20.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499040,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,45.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499041,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,60.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499042,CCC(=O)N1CCN(c2c(C(F)(F)F)cc(-n3c(=O)ccc4cnc5ccc(-c6cc7ccccc7nc6)cc5c43)cc2)CC1,608.22679,[M+H]+,45.0,val,CCC(=O)N1CCN(c2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
499043,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,653.22847,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499044,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,653.22847,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499045,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,653.22847,[M-H]-,60.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499046,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,653.22847,[M-H]-,30.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499047,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,653.22847,[M-H]-,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499048,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,699.23395,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499049,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,699.23395,[M+FA]-,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499050,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,699.23395,[M+FA]-,60.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499051,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,655.24302,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499052,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,655.24302,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499053,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,655.24302,[M+H]+,60.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499054,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,655.24302,[M+H]+,20.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499055,CC(C)Oc1c(-n2c(CN3CCN(C(=O)COc4ccc(Cl)cc4)CC3)nc3ccccc3c2=O)cc(C(=O)Cn2ccnc2)cc1,655.24302,[M+H]+,45.0,val,CC(C)Oc1ccc(C(=O)Cn2ccnc2)cc1-n1c(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
499056,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I,1584.6827,[M+Cl]-,20.0,val,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
499057,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I,1584.6827,[M+Cl]-,20.0,val,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
499058,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I,1584.6827,[M+Cl]-,15.0,val,CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
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499114,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,20.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499115,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,60.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499116,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,15.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499117,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,20.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499118,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,15.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499119,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,684.30145,[M+NH4]+,20.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)cc3)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
499120,COc1c(OC)cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3cc(O)c(O)cc3)CC(=O)CCc3cc(O)c(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)cc1,697.25018,[M-H]-,20.0,val,COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](OC(CCc3ccc(O)c(O)c3)CC(=O)CCc3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)cc1OC
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499231,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,759.43861,[M+H]+,15.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499232,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,759.43861,[M+H]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499233,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499234,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499235,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,60.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499236,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,15.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499237,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499238,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,60.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499239,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,15.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499240,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,776.46516,[M+NH4]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499241,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499242,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,20.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499243,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,60.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499244,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,15.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499245,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,45.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499246,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C,781.42056,[M+Na]+,60.0,val,CC(O)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C)C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C
499247,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,747.15102,[M-H]-,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499248,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,747.15102,[M-H]-,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499249,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,747.15102,[M-H]-,60.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499250,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,747.15102,[M-H]-,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499251,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,747.15102,[M-H]-,45.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499252,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499253,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499254,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,60.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499255,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,45.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499256,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,60.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499257,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,749.16557,[M+H]+,45.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499258,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,766.19212,[M+NH4]+,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499259,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,766.19212,[M+NH4]+,60.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499260,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,771.14751,[M+Na]+,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499261,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,771.14751,[M+Na]+,20.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499262,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,771.14751,[M+Na]+,60.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499263,CCN(Cc1cc(S(=O)(=O)[O-])ccc1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cc(S(=O)(=O)O)ccc3)C=C2)c2ccccc2S(=O)(=O)O)cc1,771.14751,[M+Na]+,45.0,val,CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](CC)Cc3cccc(S(=O)(=O)O)c3)C=C2)c2ccccc2S(=O)(=O)O)cc1
499264,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,735.21631,[M+FA]-,15.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499265,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,735.21631,[M+FA]-,15.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499266,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,735.21631,[M+FA]-,20.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499267,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,735.21631,[M+FA]-,60.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499268,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,735.21631,[M+FA]-,15.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499269,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,691.22539,[M+H]+,20.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499270,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,691.22539,[M+H]+,20.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499271,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,691.22539,[M+H]+,60.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499272,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,691.22539,[M+H]+,15.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499273,O=C(NC1(c2ccccc2)CC1)c1c2ccc(Br)cc2nc(-c2cc(C(F)(F)F)ccc2)c1CN1CCC(N2CCCCC2)CC1,691.22539,[M+H]+,20.0,val,O=C(NC1(c2ccccc2)CC1)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2cccc(C(F)(F)F)c2)nc2cc(Br)ccc12
499274,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499275,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,60.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499276,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,45.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499277,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499278,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499279,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,60.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499280,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,45.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499281,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc(OC)c(c3)Oc3c(O)c(OC)cc4c3[C@H](C2)N(C)CC4)CCN1C,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)N(C)CC3
499282,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc(OC)c(c3)Oc3c(O)c(OC)cc4c3[C@H](C2)N(C)CC4)CCN1C,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)N(C)CC3
499283,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc(OC)c(c3)Oc3c(O)c(OC)cc4c3[C@H](C2)N(C)CC4)CCN1C,609.29591,[M+H]+,60.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)N(C)CC3
499284,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc(OC)c(c3)Oc3c(O)c(OC)cc4c3[C@H](C2)N(C)CC4)CCN1C,609.29591,[M+H]+,45.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)N(C)CC3
499285,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499286,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499287,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,60.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499288,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499289,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,45.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499290,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499291,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499292,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,60.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499293,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,20.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499294,COc1c2cc3c(c1)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@@H]1c3c(O2)c(OC)c(OC)cc3CCN1C,609.29591,[M+H]+,45.0,val,COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
499295,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499296,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499297,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,45.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499298,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,60.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499299,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499300,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,60.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499301,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,45.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499302,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3,609.29591,[M+H]+,20.0,val,COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)N(C)CC3
499303,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499304,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499305,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,45.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499306,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,60.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499307,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,60.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499308,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,811.26662,[M-H]-,45.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499309,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,847.24329,[M+Cl]-,15.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499310,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,847.24329,[M+Cl]-,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499311,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,847.24329,[M+Cl]-,60.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499312,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,847.24329,[M+Cl]-,15.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499313,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,813.28117,[M+H]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499314,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,813.28117,[M+H]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499315,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,813.28117,[M+H]+,60.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499316,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,813.28117,[M+H]+,15.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499317,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,813.28117,[M+H]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499318,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,830.30772,[M+NH4]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499319,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,830.30772,[M+NH4]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499320,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,830.30772,[M+NH4]+,60.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499321,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,830.30772,[M+NH4]+,15.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499322,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O,830.30772,[M+NH4]+,20.0,val,CC(=O)OC1C(OCCc2ccc(O)c(O)c2)OC(COC2OC(C)C(O)C(O)C2O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC1OC(C)C(O)C(O)C1O
499323,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499324,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499325,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,60.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499326,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499327,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,45.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499328,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,60.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499329,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499330,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,45.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499331,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499332,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499333,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,60.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499334,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,20.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499335,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1,597.46258,[M]+,45.0,val,C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(=O)CC)CCCCC1
499336,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499337,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499338,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,60.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499339,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,30.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499340,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499341,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,60.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499342,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,30.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499343,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,783.21217,[M-H]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499344,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,819.18884,[M+Cl]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499345,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,819.18884,[M+Cl]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499346,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,819.18884,[M+Cl]-,60.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499347,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,819.18884,[M+Cl]-,15.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499348,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,819.18884,[M+Cl]-,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499349,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499350,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499351,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,60.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499352,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499353,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,45.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499354,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,60.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
499355,Cc1c(C)c2c(s1)-n1c(C)nnc1[C@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)N=C2c1ccc(Cl)cc1,785.22672,[M+H]+,20.0,val,Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCNC(=O)COc1cccc3c1C(=O)N(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
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499517,C[C@@H]1O[C@@H]1P(=O)(O)O,137.00092,[M-H]-,30.0,val,C[C@@H]1O[C@@H]1P(=O)(O)O
499518,C[C@@H]1O[C@@H]1P(=O)(O)O,137.00092,[M-H]-,20.0,val,C[C@@H]1O[C@@H]1P(=O)(O)O
499519,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,791.23208,[M+FA]-,20.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499520,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,791.23208,[M+FA]-,20.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499521,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,791.23208,[M+FA]-,60.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499522,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,791.23208,[M+FA]-,15.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499523,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,791.23208,[M+FA]-,20.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499524,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,747.24116,[M+H]+,30.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499525,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,747.24116,[M+H]+,30.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499526,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,747.24116,[M+H]+,60.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499527,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,747.24116,[M+H]+,20.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499528,COc1c(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)ccc(-c2cc(OC)c(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)cc2)c1,747.24116,[M+H]+,30.0,val,COc1cc(-c2ccc(-n3nc(-c4ccccc4)n[n+]3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-n1nc(-c2ccccc2)n[n+]1-c1ccc([N+](=O)[O-])cc1
499529,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,738.27,[M-H]-,20.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499530,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,738.27,[M-H]-,20.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499531,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,738.27,[M-H]-,60.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499532,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,738.27,[M-H]-,15.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499533,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,738.27,[M-H]-,20.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499534,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,740.28455,[M+H]+,30.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499535,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,740.28455,[M+H]+,30.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499536,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,740.28455,[M+H]+,20.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499537,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,740.28455,[M+H]+,60.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499538,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1c2ccc(=O)[nH]c2c(O)cc1,740.28455,[M+H]+,30.0,val,COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
499539,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,691.29597,[M-H]-,20.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499540,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,691.29597,[M-H]-,20.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499541,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,691.29597,[M-H]-,60.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499542,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,691.29597,[M-H]-,30.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499543,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,693.31052,[M+H]+,20.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499544,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,693.31052,[M+H]+,20.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499545,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,693.31052,[M+H]+,30.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499546,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,693.31052,[M+H]+,60.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499547,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4c3ccc(OC[C@@H]3Cc5ccccc5N3C(C)=O)c4)cc2)nc1,693.31052,[M+H]+,20.0,val,COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OC[C@@H]5Cc6ccccc6N5C(C)=O)ccc43)cc2)nc1
499548,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499549,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499550,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,60.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499551,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,45.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499552,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,60.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499553,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,45.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499554,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499555,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499556,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,30.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499557,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,60.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499558,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499559,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,45.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499560,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,60.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499561,CCOc1c(C2=N[C@@](C)(c3ccc(Cl)cc3)[C@@](C)(c3ccc(Cl)cc3)N2C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)ccc(C(C)(C)C)c1,734.32344,[M+H]+,20.0,val,CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1
499562,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499563,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499564,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,60.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
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499569,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499570,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,45.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499571,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499572,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,15.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499573,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,15.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499574,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499575,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,60.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499576,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499577,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499578,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,60.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499579,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,15.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499580,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499581,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,60.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499582,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,737.37805,[M-H]-,15.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
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499598,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,60.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499599,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,20.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499600,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C,739.39261,[M+H]+,45.0,val,COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C
499601,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,845.38393,[M+FA]-,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499602,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,845.38393,[M+FA]-,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499603,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,845.38393,[M+FA]-,60.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499604,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,845.38393,[M+FA]-,15.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499605,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,845.38393,[M+FA]-,60.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499606,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,801.393,[M+H]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499607,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,801.393,[M+H]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499608,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,801.393,[M+H]+,60.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499609,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,801.393,[M+H]+,15.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499610,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,801.393,[M+H]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499611,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,818.41955,[M+NH4]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499612,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,818.41955,[M+NH4]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499613,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,818.41955,[M+NH4]+,60.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499614,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,818.41955,[M+NH4]+,15.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499615,CC(C)=CCc1c(O)ccc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)c1,818.41955,[M+NH4]+,20.0,val,CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)C3CCCN3C(=O)CNC(=O)C(C(C)C)NC(=O)CNC2=O)ccc1O
499616,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,799.40409,[M+Cl]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499617,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,799.40409,[M+Cl]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499618,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,809.43289,[M+FA]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499619,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,809.43289,[M+FA]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499620,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,809.43289,[M+FA]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499621,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,763.42742,[M-H]-,20.0,val,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
499622,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,763.42742,[M-H]-,20.0,val,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
499623,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,763.42742,[M-H]-,60.0,val,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
499624,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,763.42742,[M-H]-,45.0,val,CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
499625,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,799.40409,[M+Cl]-,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499626,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,782.46852,[M+NH4]+,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
499627,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O,782.46852,[M+NH4]+,20.0,val,C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O
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500152,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,889.52838,[M+Na]+,60.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500153,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,884.57298,[M+NH4]+,20.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500154,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,884.57298,[M+NH4]+,20.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500155,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,884.57298,[M+NH4]+,60.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500156,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,884.57298,[M+NH4]+,15.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500157,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,884.57298,[M+NH4]+,20.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500158,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,889.52838,[M+Na]+,20.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500159,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,889.52838,[M+Na]+,20.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500160,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,889.52838,[M+Na]+,60.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500161,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C,889.52838,[M+Na]+,45.0,val,CO[C@H]1CC[C@@H](O[C@H]2C[C@H]([C@]3(C)CC[C@]4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)[C@H](C)C[C@H](C)C(=O)O)O4)O3)O[C@]3(O[C@@H]([C@H]4O[C@@](O)(CO)[C@H](C)C[C@@H]4C)C[C@@H]3C)[C@@H]2C)O[C@@H]1C
500162,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500163,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500164,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,60.0,val,O=c1cc(Cl)[nH]nc1Cl
500165,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500166,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,45.0,val,O=c1cc(Cl)[nH]nc1Cl
500167,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,60.0,val,O=c1cc(Cl)[nH]nc1Cl
500168,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500169,O=c1cc(Cl)[nH]nc1Cl,162.94714,[M-H]-,45.0,val,O=c1cc(Cl)[nH]nc1Cl
500170,O=c1cc(Cl)[nH]nc1Cl,164.96169,[M+H]+,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500171,O=c1cc(Cl)[nH]nc1Cl,164.96169,[M+H]+,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500172,O=c1cc(Cl)[nH]nc1Cl,164.96169,[M+H]+,60.0,val,O=c1cc(Cl)[nH]nc1Cl
500173,O=c1cc(Cl)[nH]nc1Cl,164.96169,[M+H]+,20.0,val,O=c1cc(Cl)[nH]nc1Cl
500174,O=c1cc(Cl)[nH]nc1Cl,164.96169,[M+H]+,45.0,val,O=c1cc(Cl)[nH]nc1Cl
500175,O=C(O)c1c(F)cn[nH]1,129.01058,[M-H]-,15.0,val,O=C(O)c1[nH]ncc1F
500176,O=C(O)c1c(F)cn[nH]1,129.01058,[M-H]-,20.0,val,O=C(O)c1[nH]ncc1F
500177,O=C(O)c1c(F)cn[nH]1,129.01058,[M-H]-,60.0,val,O=C(O)c1[nH]ncc1F
500178,O=C(O)c1c(F)cn[nH]1,129.01058,[M-H]-,15.0,val,O=C(O)c1[nH]ncc1F
500179,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,20.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500180,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,60.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500181,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,15.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500182,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,20.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500183,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,20.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500184,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,60.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500185,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,30.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500186,O=c1[nH]cc(F)c(=O)[nH]1,129.01058,[M-H]-,20.0,val,O=c1[nH]cc(F)c(=O)[nH]1
500187,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500188,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500189,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,60.0,val,Nc1[nH]c(=O)ncc1F
500190,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500191,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,45.0,val,Nc1[nH]c(=O)ncc1F
500192,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500193,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500194,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,60.0,val,Nc1[nH]c(=O)ncc1F
500195,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500196,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,45.0,val,Nc1[nH]c(=O)ncc1F
500197,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,60.0,val,Nc1[nH]c(=O)ncc1F
500198,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,20.0,val,Nc1[nH]c(=O)ncc1F
500199,Nc1c(F)cnc(=O)[nH]1,130.04112,[M+H]+,45.0,val,Nc1[nH]c(=O)ncc1F
500200,O=C(O)Cc1csnn1,145.00662,[M+H]+,20.0,val,O=C(O)Cc1csnn1
500201,O=C(O)Cc1csnn1,145.00662,[M+H]+,20.0,val,O=C(O)Cc1csnn1
500202,O=C(O)Cc1csnn1,145.00662,[M+H]+,60.0,val,O=C(O)Cc1csnn1
500203,O=C(O)Cc1csnn1,145.00662,[M+H]+,20.0,val,O=C(O)Cc1csnn1
500204,O=C(O)Cc1csnn1,145.00662,[M+H]+,45.0,val,O=C(O)Cc1csnn1
500205,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,20.0,val,O=C1CC(=O)NC(S)=N1
500206,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,45.0,val,O=C1CC(=O)NC(S)=N1
500207,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,60.0,val,O=C1CC(=O)NC(S)=N1
500208,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,20.0,val,O=C1CC(=O)NC(S)=N1
500209,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,20.0,val,O=C1CC(=O)NC(S)=N1
500210,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,45.0,val,O=C1CC(=O)NC(S)=N1
500211,O=C1CC(=O)NC(S)=N1,142.99207,[M-H]-,60.0,val,O=C1CC(=O)NC(S)=N1
500212,Nc1cc(=O)[nH]c(N)n1,127.06144,[M+H]+,20.0,val,Nc1cc(=O)[nH]c(N)n1
500213,Nc1cc(=O)[nH]c(N)n1,127.06144,[M+H]+,20.0,val,Nc1cc(=O)[nH]c(N)n1
500214,Nc1cc(=O)[nH]c(N)n1,127.06144,[M+H]+,60.0,val,Nc1cc(=O)[nH]c(N)n1
500215,Nc1cc(=O)[nH]c(N)n1,127.06144,[M+H]+,20.0,val,Nc1cc(=O)[nH]c(N)n1
500216,Nc1cc(=O)[nH]c(N)n1,127.06144,[M+H]+,45.0,val,Nc1cc(=O)[nH]c(N)n1
500217,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500218,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500219,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500220,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500221,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500222,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500223,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500224,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500225,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500226,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500227,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500228,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500229,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500230,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500231,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500232,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500233,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500234,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500235,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500236,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500237,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500238,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500239,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500240,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500241,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500242,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500243,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500244,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500245,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500246,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500247,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500248,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500249,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500250,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500251,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500252,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500253,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,60.0,val,O=C(O)C(O)C(O)C(=O)O
500254,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,30.0,val,O=C(O)C(O)C(O)C(=O)O
500255,O=C(O)C(O)C(O)C(=O)O,149.00916,[M-H]-,20.0,val,O=C(O)C(O)C(O)C(=O)O
500256,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,886.43831,[M-H]-,20.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500257,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,886.43831,[M-H]-,60.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500258,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,886.43831,[M-H]-,45.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500259,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,886.43831,[M-H]-,60.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500260,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,886.43831,[M-H]-,45.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500261,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,20.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500262,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,20.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500263,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,60.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500264,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,15.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500265,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,20.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500266,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,60.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500267,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,15.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500268,COc1cc(O)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(C)c1,888.45287,[M+H]+,20.0,val,COc1cc(C)c(C(=O)NC2C(C)OC(OC3CCC(C)C4C3C=C(C)C3C(C)=CCCC(C)=CC5(C)C=C(C(=O)O)C(C)CC56OC(=O)/C(=C(\O)C34C)C6=O)C(O)C2(C)O)c(O)c1
500269,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1081.54363,[M+FA]-,20.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500270,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1081.54363,[M+FA]-,60.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500271,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,20.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500272,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,20.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500273,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,60.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500274,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,15.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500275,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,20.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500276,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,60.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
500277,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O,1054.57925,[M+NH4]+,15.0,val,C=CC(C)(CCC1(C)C(C)CC(OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C2(C)C(C)=CCCC12)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O
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500806,O=C(O)CN1CCCC1,130.08625,[M+H]+,60.0,val,O=C(O)CN1CCCC1
500807,O=C(O)CN1CCCC1,130.08625,[M+H]+,30.0,val,O=C(O)CN1CCCC1
500808,O=C(O)CN1CCCC1,130.08625,[M+H]+,20.0,val,O=C(O)CN1CCCC1
500809,O=C(O)CN1CCCC1,130.08625,[M+H]+,60.0,val,O=C(O)CN1CCCC1
500810,O=C(O)CN1CCCC1,130.08625,[M+H]+,30.0,val,O=C(O)CN1CCCC1
500811,O=C(O)CN1CCCC1,130.08625,[M+H]+,20.0,val,O=C(O)CN1CCCC1
500812,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500813,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500814,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,60.0,val,O=C(O)[C@H]1CCCCN1
500815,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,30.0,val,O=C(O)[C@H]1CCCCN1
500816,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500817,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,20.0,val,CN(CC(=O)O)C1CC1
500818,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,20.0,val,CN(CC(=O)O)C1CC1
500819,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,60.0,val,CN(CC(=O)O)C1CC1
500820,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,30.0,val,CN(CC(=O)O)C1CC1
500821,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,20.0,val,CN(CC(=O)O)C1CC1
500822,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,60.0,val,CN(CC(=O)O)C1CC1
500823,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,30.0,val,CN(CC(=O)O)C1CC1
500824,CN(CC(=O)O)C1CC1,130.08625,[M+H]+,20.0,val,CN(CC(=O)O)C1CC1
500825,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500826,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500827,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,60.0,val,O=C(O)[C@H]1CCCCN1
500828,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,30.0,val,O=C(O)[C@H]1CCCCN1
500829,O=C(O)[C@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@H]1CCCCN1
500830,O=C(O)[C@@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@@H]1CCCCN1
500831,O=C(O)[C@@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@@H]1CCCCN1
500832,O=C(O)[C@@H]1CCCCN1,130.08625,[M+H]+,60.0,val,O=C(O)[C@@H]1CCCCN1
500833,O=C(O)[C@@H]1CCCCN1,130.08625,[M+H]+,30.0,val,O=C(O)[C@@H]1CCCCN1
500834,O=C(O)[C@@H]1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)[C@@H]1CCCCN1
500835,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500836,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500837,C=CC(N)CCC(=O)O,130.08625,[M+H]+,60.0,val,C=CC(N)CCC(=O)O
500838,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500839,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500840,C=CC(N)CCC(=O)O,147.1128,[M+NH4]+,20.0,val,C=CC(N)CCC(=O)O
500841,C=CC(N)CCC(=O)O,147.1128,[M+NH4]+,20.0,val,C=CC(N)CCC(=O)O
500842,C=CC(N)CCC(=O)O,147.1128,[M+NH4]+,60.0,val,C=CC(N)CCC(=O)O
500843,C=CC(N)CCC(=O)O,147.1128,[M+NH4]+,15.0,val,C=CC(N)CCC(=O)O
500844,C=CC(N)CCC(=O)O,147.1128,[M+NH4]+,20.0,val,C=CC(N)CCC(=O)O
500845,O=C(O)C1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)C1CCCCN1
500846,O=C(O)C1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)C1CCCCN1
500847,O=C(O)C1CCCCN1,130.08625,[M+H]+,60.0,val,O=C(O)C1CCCCN1
500848,O=C(O)C1CCCCN1,130.08625,[M+H]+,30.0,val,O=C(O)C1CCCCN1
500849,O=C(O)C1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)C1CCCCN1
500850,O=C(O)C1CCCCN1,130.08625,[M+H]+,60.0,val,O=C(O)C1CCCCN1
500851,O=C(O)C1CCCCN1,130.08625,[M+H]+,30.0,val,O=C(O)C1CCCCN1
500852,O=C(O)C1CCCCN1,130.08625,[M+H]+,20.0,val,O=C(O)C1CCCCN1
500853,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,20.0,val,NC1(C(=O)O)CCCC1
500854,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,20.0,val,NC1(C(=O)O)CCCC1
500855,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,60.0,val,NC1(C(=O)O)CCCC1
500856,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,30.0,val,NC1(C(=O)O)CCCC1
500857,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,20.0,val,NC1(C(=O)O)CCCC1
500858,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,60.0,val,NC1(C(=O)O)CCCC1
500859,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,30.0,val,NC1(C(=O)O)CCCC1
500860,NC1(C(=O)O)CCCC1,130.08625,[M+H]+,20.0,val,NC1(C(=O)O)CCCC1
500861,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500862,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500863,C=CC(N)CCC(=O)O,130.08625,[M+H]+,60.0,val,C=CC(N)CCC(=O)O
500864,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500865,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500866,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500867,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500868,C=CC(N)CCC(=O)O,130.08625,[M+H]+,60.0,val,C=CC(N)CCC(=O)O
500869,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500870,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500871,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500872,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500873,C=CC(N)CCC(=O)O,130.08625,[M+H]+,20.0,val,C=CC(N)CCC(=O)O
500874,C=CC(N)CCC(=O)O,130.08625,[M+H]+,60.0,val,C=CC(N)CCC(=O)O
500875,C=CC(N)CCC(=O)O,130.08625,[M+H]+,15.0,val,C=CC(N)CCC(=O)O
500876,CN1CCC[C@H]1C(=O)O,130.08625,[M+H]+,20.0,val,CN1CCC[C@H]1C(=O)O
500877,CN1CCC[C@H]1C(=O)O,130.08625,[M+H]+,60.0,val,CN1CCC[C@H]1C(=O)O
500878,CN1CCC[C@H]1C(=O)O,130.08625,[M+H]+,30.0,val,CN1CCC[C@H]1C(=O)O
500879,CN1CCC[C@H]1C(=O)O,130.08625,[M+H]+,20.0,val,CN1CCC[C@H]1C(=O)O
500880,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500881,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500882,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,60.0,val,S=P(N1CC1)(N1CC1)N1CC1
500883,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,15.0,val,S=P(N1CC1)(N1CC1)N1CC1
500884,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500885,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500886,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500887,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,60.0,val,S=P(N1CC1)(N1CC1)N1CC1
500888,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,15.0,val,S=P(N1CC1)(N1CC1)N1CC1
500889,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500890,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,60.0,val,S=P(N1CC1)(N1CC1)N1CC1
500891,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,15.0,val,S=P(N1CC1)(N1CC1)N1CC1
500892,S=P(N1CC1)(N1CC1)N1CC1,190.05623,[M+H]+,20.0,val,S=P(N1CC1)(N1CC1)N1CC1
500893,CCCCC(O)C(=O)O,131.07137,[M-H]-,20.0,val,CCCCC(O)C(=O)O
500894,CCCCC(O)C(=O)O,131.07137,[M-H]-,20.0,val,CCCCC(O)C(=O)O
500895,CCCCC(O)C(=O)O,131.07137,[M-H]-,60.0,val,CCCCC(O)C(=O)O
500896,CCCCC(O)C(=O)O,131.07137,[M-H]-,30.0,val,CCCCC(O)C(=O)O
500897,CCCCC(O)C(=O)O,131.07137,[M-H]-,20.0,val,CCCCC(O)C(=O)O
500898,CC(C)C[C@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@H](O)C(=O)O
500899,CC(C)C[C@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@H](O)C(=O)O
500900,CC(C)C[C@H](O)C(=O)O,131.07137,[M-H]-,60.0,val,CC(C)C[C@H](O)C(=O)O
500901,CC(C)C[C@H](O)C(=O)O,131.07137,[M-H]-,30.0,val,CC(C)C[C@H](O)C(=O)O
500902,CC(C)C[C@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@H](O)C(=O)O
500903,CC(C)C[C@@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@@H](O)C(=O)O
500904,CC(C)C[C@@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@@H](O)C(=O)O
500905,CC(C)C[C@@H](O)C(=O)O,131.07137,[M-H]-,60.0,val,CC(C)C[C@@H](O)C(=O)O
500906,CC(C)C[C@@H](O)C(=O)O,131.07137,[M-H]-,30.0,val,CC(C)C[C@@H](O)C(=O)O
500907,CC(C)C[C@@H](O)C(=O)O,131.07137,[M-H]-,20.0,val,CC(C)C[C@@H](O)C(=O)O
500908,C[N+](C)(C)NCCC(=O)O,147.1128,[M]+,20.0,val,C[N+](C)(C)NCCC(=O)O
500909,C[N+](C)(C)NCCC(=O)O,147.1128,[M]+,20.0,val,C[N+](C)(C)NCCC(=O)O
500910,C[N+](C)(C)NCCC(=O)O,147.1128,[M]+,30.0,val,C[N+](C)(C)NCCC(=O)O
500911,C[N+](C)(C)NCCC(=O)O,147.1128,[M]+,60.0,val,C[N+](C)(C)NCCC(=O)O
500912,C[N+](C)(C)NCCC(=O)O,147.1128,[M]+,20.0,val,C[N+](C)(C)NCCC(=O)O
500913,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,276.04075,[M-H]-,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500914,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,276.04075,[M-H]-,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500915,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,276.04075,[M-H]-,60.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500916,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,276.04075,[M-H]-,30.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500917,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,276.04075,[M-H]-,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500918,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,278.0553,[M+H]+,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500919,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,278.0553,[M+H]+,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500920,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,278.0553,[M+H]+,60.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500921,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,278.0553,[M+H]+,30.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500922,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O,278.0553,[M+H]+,20.0,val,NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O
500923,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,20.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500924,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,20.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500925,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,60.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500926,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,30.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500927,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,20.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500928,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,60.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500929,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,30.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500930,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl,244.87361,[M-H]-,20.0,val,Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl
500931,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,20.0,val,Oc1c(Br)cc(Br)cc1Br
500932,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,20.0,val,Oc1c(Br)cc(Br)cc1Br
500933,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,45.0,val,Oc1c(Br)cc(Br)cc1Br
500934,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,60.0,val,Oc1c(Br)cc(Br)cc1Br
500935,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,20.0,val,Oc1c(Br)cc(Br)cc1Br
500936,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,60.0,val,Oc1c(Br)cc(Br)cc1Br
500937,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,45.0,val,Oc1c(Br)cc(Br)cc1Br
500938,Oc1c(Br)cc(Br)cc1Br,326.76612,[M-H]-,20.0,val,Oc1c(Br)cc(Br)cc1Br
500939,O=C(O)c1ccc(C(F)(F)F)s1,194.97331,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)s1
500940,O=C(O)c1ccc(C(F)(F)F)s1,194.97331,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)s1
500941,O=C(O)c1ccc(C(F)(F)F)s1,194.97331,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)(F)F)s1
500942,O=C(O)c1ccc(C(F)(F)F)s1,194.97331,[M-H]-,15.0,val,O=C(O)c1ccc(C(F)(F)F)s1
500943,O=C(O)c1ccc(C(F)(F)F)s1,194.97331,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)s1
500944,O=S(=O)(O)c1c(O)c(Cl)cc(Cl)c1,240.91346,[M-H]-,20.0,val,O=S(=O)(O)c1cc(Cl)cc(Cl)c1O
500945,O=S(=O)(O)c1c(O)c(Cl)cc(Cl)c1,240.91346,[M-H]-,20.0,val,O=S(=O)(O)c1cc(Cl)cc(Cl)c1O
500946,O=S(=O)(O)c1c(O)c(Cl)cc(Cl)c1,240.91346,[M-H]-,60.0,val,O=S(=O)(O)c1cc(Cl)cc(Cl)c1O
500947,O=S(=O)(O)c1c(O)c(Cl)cc(Cl)c1,240.91346,[M-H]-,20.0,val,O=S(=O)(O)c1cc(Cl)cc(Cl)c1O
500948,O=S(=O)(O)c1c(O)c(Cl)cc(Cl)c1,240.91346,[M-H]-,45.0,val,O=S(=O)(O)c1cc(Cl)cc(Cl)c1O
500949,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,20.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500950,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,20.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500951,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,60.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500952,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,30.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500953,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,20.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500954,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,60.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500955,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,30.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500956,O=C(O)c1c[nH]c(C(F)(F)F)c1,178.01214,[M-H]-,20.0,val,O=C(O)c1c[nH]c(C(F)(F)F)c1
500957,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500958,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500959,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500960,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,30.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500961,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500962,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500963,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,30.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500964,O=C(O)c1ccc(C(F)(F)F)[nH]1,178.01214,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)[nH]1
500965,O=c1[nH]c(=O)c2nccnc2[nH]1,163.02615,[M-H]-,20.0,val,O=c1[nH]c(=O)c2nccnc2[nH]1
500966,O=c1[nH]c(=O)c2nccnc2[nH]1,163.02615,[M-H]-,20.0,val,O=c1[nH]c(=O)c2nccnc2[nH]1
500967,O=c1[nH]c(=O)c2nccnc2[nH]1,163.02615,[M-H]-,60.0,val,O=c1[nH]c(=O)c2nccnc2[nH]1
500968,O=c1[nH]c(=O)c2nccnc2[nH]1,163.02615,[M-H]-,30.0,val,O=c1[nH]c(=O)c2nccnc2[nH]1
500969,O=c1[nH]c(=O)c2nccnc2[nH]1,163.02615,[M-H]-,20.0,val,O=c1[nH]c(=O)c2nccnc2[nH]1
500970,O=C1C=C(O)C(=O)C=C1O,139.00368,[M-H]-,20.0,val,O=C1C=C(O)C(=O)C=C1O
500971,O=C1C=C(O)C(=O)C=C1O,139.00368,[M-H]-,20.0,val,O=C1C=C(O)C(=O)C=C1O
500972,O=C1C=C(O)C(=O)C=C1O,139.00368,[M-H]-,45.0,val,O=C1C=C(O)C(=O)C=C1O
500973,O=C1C=C(O)C(=O)C=C1O,139.00368,[M-H]-,60.0,val,O=C1C=C(O)C(=O)C=C1O
500974,O=C1C=C(O)C(=O)C=C1O,139.00368,[M-H]-,20.0,val,O=C1C=C(O)C(=O)C=C1O
500975,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1,234.95858,[M-H]-,20.0,val,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1
500976,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1,234.95858,[M-H]-,20.0,val,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1
500977,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1,234.95858,[M-H]-,60.0,val,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1
500978,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1,234.95858,[M-H]-,15.0,val,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1
500979,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1,234.95858,[M-H]-,20.0,val,CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1
500980,Nn1nnc2ccccc21,135.06652,[M+H]+,20.0,val,Nn1nnc2ccccc21
500981,Nn1nnc2ccccc21,135.06652,[M+H]+,20.0,val,Nn1nnc2ccccc21
500982,Nn1nnc2ccccc21,135.06652,[M+H]+,60.0,val,Nn1nnc2ccccc21
500983,Nn1nnc2ccccc21,135.06652,[M+H]+,20.0,val,Nn1nnc2ccccc21
500984,Nn1nnc2ccccc21,135.06652,[M+H]+,45.0,val,Nn1nnc2ccccc21
500985,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,20.0,val,O=C(O)C1CSc2cnnn2C1
500986,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,20.0,val,O=C(O)C1CSc2cnnn2C1
500987,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,60.0,val,O=C(O)C1CSc2cnnn2C1
500988,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,15.0,val,O=C(O)C1CSc2cnnn2C1
500989,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,20.0,val,O=C(O)C1CSc2cnnn2C1
500990,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,60.0,val,O=C(O)C1CSc2cnnn2C1
500991,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,15.0,val,O=C(O)C1CSc2cnnn2C1
500992,O=C(O)C1CSc2cnnn2C1,184.01862,[M-H]-,20.0,val,O=C(O)C1CSc2cnnn2C1
500993,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,20.0,val,O=C(O)C1CSc2cnnn2C1
500994,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,20.0,val,O=C(O)C1CSc2cnnn2C1
500995,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,60.0,val,O=C(O)C1CSc2cnnn2C1
500996,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,15.0,val,O=C(O)C1CSc2cnnn2C1
500997,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,20.0,val,O=C(O)C1CSc2cnnn2C1
500998,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,45.0,val,O=C(O)C1CSc2cnnn2C1
500999,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,60.0,val,O=C(O)C1CSc2cnnn2C1
501000,O=C(O)C1CSc2cnnn2C1,186.03317,[M+H]+,20.0,val,O=C(O)C1CSc2cnnn2C1
501001,CNc1nc(=O)c2[nH]cnc2[nH]1,166.07234,[M+H]+,20.0,val,CNc1nc(=O)c2[nH]cnc2[nH]1
501002,CNc1nc(=O)c2[nH]cnc2[nH]1,166.07234,[M+H]+,20.0,val,CNc1nc(=O)c2[nH]cnc2[nH]1
501003,CNc1nc(=O)c2[nH]cnc2[nH]1,166.07234,[M+H]+,60.0,val,CNc1nc(=O)c2[nH]cnc2[nH]1
501004,CNc1nc(=O)c2[nH]cnc2[nH]1,166.07234,[M+H]+,20.0,val,CNc1nc(=O)c2[nH]cnc2[nH]1
501005,CNc1nc(=O)c2[nH]cnc2[nH]1,166.07234,[M+H]+,60.0,val,CNc1nc(=O)c2[nH]cnc2[nH]1
501006,Cc1c(CCCl)scn1,162.01387,[M+H]+,60.0,val,Cc1ncsc1CCCl
501007,Cc1c(CCCl)scn1,162.01387,[M+H]+,60.0,val,Cc1ncsc1CCCl
501008,Cc1c(CCCl)scn1,162.01387,[M+H]+,20.0,val,Cc1ncsc1CCCl
501009,Cc1c(CCCl)scn1,162.01387,[M+H]+,60.0,val,Cc1ncsc1CCCl
501010,Cc1c(CCCl)scn1,162.01387,[M+H]+,60.0,val,Cc1ncsc1CCCl
501011,Cc1c(CCCl)scn1,162.01387,[M+H]+,20.0,val,Cc1ncsc1CCCl
501012,Cc1c(CCCl)scn1,162.01387,[M+H]+,20.0,val,Cc1ncsc1CCCl
501013,Cc1c(CCCl)scn1,162.01387,[M+H]+,60.0,val,Cc1ncsc1CCCl
501014,Cc1c(CCCl)scn1,162.01387,[M+H]+,20.0,val,Cc1ncsc1CCCl
501015,Cc1c(CCCl)scn1,162.01387,[M+H]+,45.0,val,Cc1ncsc1CCCl
501016,O=C(O)CC1CCC(=O)N1,142.05097,[M-H]-,20.0,val,O=C(O)CC1CCC(=O)N1
501017,O=C(O)CC1CCC(=O)N1,142.05097,[M-H]-,60.0,val,O=C(O)CC1CCC(=O)N1
501018,O=C(O)CC1CCC(=O)N1,142.05097,[M-H]-,20.0,val,O=C(O)CC1CCC(=O)N1
501019,O=C(O)CC1CCC(=O)N1,144.06552,[M+H]+,20.0,val,O=C(O)CC1CCC(=O)N1
501020,O=C(O)CC1CCC(=O)N1,144.06552,[M+H]+,20.0,val,O=C(O)CC1CCC(=O)N1
501021,O=C(O)CC1CCC(=O)N1,144.06552,[M+H]+,60.0,val,O=C(O)CC1CCC(=O)N1
501022,O=C(O)CC1CCC(=O)N1,144.06552,[M+H]+,30.0,val,O=C(O)CC1CCC(=O)N1
501023,O=C(O)CC1CCC(=O)N1,144.06552,[M+H]+,20.0,val,O=C(O)CC1CCC(=O)N1
501024,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1249.73946,[M+FA]-,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501025,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1249.73946,[M+FA]-,60.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501026,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1249.73946,[M+FA]-,15.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501027,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1239.71066,[M+Cl]-,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501028,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1239.71066,[M+Cl]-,30.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501029,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1249.73946,[M+FA]-,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501030,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1249.73946,[M+FA]-,60.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501031,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501032,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501033,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,60.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501034,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,30.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501035,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501036,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501037,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,60.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501038,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,30.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501039,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501040,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,20.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501041,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,60.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501042,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1,1205.74854,[M+H]+,30.0,val,CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C1CCCCC1
501043,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1618.70309,[M-H]-,20.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501044,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1618.70309,[M-H]-,60.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501045,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1618.70309,[M-H]-,30.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501046,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1619.71037,[M]-,20.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501047,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1619.71037,[M]-,60.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501048,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1619.71037,[M]-,60.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501049,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1620.71764,[M+H]+,20.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501050,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1620.71764,[M+H]+,20.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501051,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1620.71764,[M+H]+,60.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501052,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C,1620.71764,[M+H]+,45.0,val,CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H]([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C
501053,CC(=O)N[C@H](Cc1cc2ccccc2cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cnccc1)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O,1415.69135,[M+H]+,20.0,val,CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
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501072,CC(C)(C)c1nnc(C(=O)O)s1,185.03902,[M-H]-,60.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501073,CN(C)C(C(=O)O)c1cscn1,151.03245,[M+H-2H2O]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501074,CN(C)C(C(=O)O)c1cscn1,151.03245,[M+H-2H2O]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501075,CN(C)C(C(=O)O)c1cscn1,151.03245,[M+H-2H2O]+,60.0,val,CN(C)C(C(=O)O)c1cscn1
501076,CN(C)C(C(=O)O)c1cscn1,151.03245,[M+H-2H2O]+,30.0,val,CN(C)C(C(=O)O)c1cscn1
501077,CN(C)C(C(=O)O)c1cscn1,151.03245,[M+H-2H2O]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501078,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501079,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501080,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,15.0,val,CN(C)C(C(=O)O)c1cscn1
501081,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,60.0,val,CN(C)C(C(=O)O)c1cscn1
501082,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,30.0,val,CN(C)C(C(=O)O)c1cscn1
501083,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501084,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,60.0,val,CN(C)C(C(=O)O)c1cscn1
501085,CN(C)C(C(=O)O)c1cscn1,187.05357,[M+H]+,20.0,val,CN(C)C(C(=O)O)c1cscn1
501086,CC(C)(C)c1nnc(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501087,CC(C)(C)c1nnc(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501088,CC(C)(C)c1nnc(C(=O)O)s1,187.05357,[M+H]+,60.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501089,CC(C)(C)c1nnc(C(=O)O)s1,187.05357,[M+H]+,30.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501090,CC(C)(C)c1nnc(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CC(C)(C)c1nnc(C(=O)O)s1
501091,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,20.0,val,Cc1nc(N(C)C)sc1C(=O)O
501092,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,20.0,val,Cc1nc(N(C)C)sc1C(=O)O
501093,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,60.0,val,Cc1nc(N(C)C)sc1C(=O)O
501094,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,20.0,val,Cc1nc(N(C)C)sc1C(=O)O
501095,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,45.0,val,Cc1nc(N(C)C)sc1C(=O)O
501096,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,60.0,val,Cc1nc(N(C)C)sc1C(=O)O
501097,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,20.0,val,Cc1nc(N(C)C)sc1C(=O)O
501098,Cc1c(C(=O)O)sc(N(C)C)n1,187.05357,[M+H]+,45.0,val,Cc1nc(N(C)C)sc1C(=O)O
501099,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CCNc1nc(C)c(C(=O)O)s1
501100,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CCNc1nc(C)c(C(=O)O)s1
501101,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,60.0,val,CCNc1nc(C)c(C(=O)O)s1
501102,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CCNc1nc(C)c(C(=O)O)s1
501103,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,45.0,val,CCNc1nc(C)c(C(=O)O)s1
501104,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,60.0,val,CCNc1nc(C)c(C(=O)O)s1
501105,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,20.0,val,CCNc1nc(C)c(C(=O)O)s1
501106,CCNc1nc(C)c(C(=O)O)s1,187.05357,[M+H]+,45.0,val,CCNc1nc(C)c(C(=O)O)s1
501107,Cc1csc(NC(C)C(=O)O)n1,187.05357,[M+H]+,20.0,val,Cc1csc(NC(C)C(=O)O)n1
501108,Cc1csc(NC(C)C(=O)O)n1,187.05357,[M+H]+,20.0,val,Cc1csc(NC(C)C(=O)O)n1
501109,Cc1csc(NC(C)C(=O)O)n1,187.05357,[M+H]+,60.0,val,Cc1csc(NC(C)C(=O)O)n1
501110,Cc1csc(NC(C)C(=O)O)n1,187.05357,[M+H]+,20.0,val,Cc1csc(NC(C)C(=O)O)n1
501111,Cc1csc(NC(C)C(=O)O)n1,187.05357,[M+H]+,45.0,val,Cc1csc(NC(C)C(=O)O)n1
501112,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501113,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501114,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,60.0,val,CC(C)c1sc(N)nc1C(=O)O
501115,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,30.0,val,CC(C)c1sc(N)nc1C(=O)O
501116,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501117,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,60.0,val,CC(C)c1sc(N)nc1C(=O)O
501118,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,30.0,val,CC(C)c1sc(N)nc1C(=O)O
501119,CC(C)c1c(C(=O)O)nc(N)s1,169.04301,[M+H-H2O]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501120,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501121,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501122,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,60.0,val,CC(C)c1sc(N)nc1C(=O)O
501123,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,30.0,val,CC(C)c1sc(N)nc1C(=O)O
501124,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501125,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,60.0,val,CC(C)c1sc(N)nc1C(=O)O
501126,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,30.0,val,CC(C)c1sc(N)nc1C(=O)O
501127,CC(C)c1c(C(=O)O)nc(N)s1,187.05357,[M+H]+,20.0,val,CC(C)c1sc(N)nc1C(=O)O
501128,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501129,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501130,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501131,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,60.0,val,NCc1ccc(S(N)(=O)=O)cc1
501132,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501133,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501134,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501135,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,60.0,val,CCOC(=O)n1ccn(C)c1=S
501136,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,30.0,val,CCOC(=O)n1ccn(C)c1=S
501137,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501138,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501139,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501140,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501141,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,60.0,val,NCc1ccc(S(N)(=O)=O)cc1
501142,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501143,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501144,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501145,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,60.0,val,NCc1ccc(S(N)(=O)=O)cc1
501146,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501147,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501148,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501149,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501150,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,60.0,val,CCOC(=O)n1ccn(C)c1=S
501151,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,30.0,val,CCOC(=O)n1ccn(C)c1=S
501152,CCOC(=O)n1ccn(C)c1=S,187.05357,[M+H]+,20.0,val,CCOC(=O)n1ccn(C)c1=S
501153,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501154,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501155,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,60.0,val,NCc1ccc(S(N)(=O)=O)cc1
501156,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,15.0,val,NCc1ccc(S(N)(=O)=O)cc1
501157,NCc1ccc(S(N)(=O)=O)cc1,187.05357,[M+H]+,20.0,val,NCc1ccc(S(N)(=O)=O)cc1
501158,NCCSSc1ccccn1,187.03582,[M+H]+,30.0,val,NCCSSc1ccccn1
501159,NCCSSc1ccccn1,187.03582,[M+H]+,30.0,val,NCCSSc1ccccn1
501160,NCCSSc1ccccn1,187.03582,[M+H]+,20.0,val,NCCSSc1ccccn1
501161,NCCSSc1ccccn1,187.03582,[M+H]+,60.0,val,NCCSSc1ccccn1
501162,NCCSSc1ccccn1,187.03582,[M+H]+,30.0,val,NCCSSc1ccccn1
501163,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501164,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501165,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501166,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,30.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501167,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501168,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501169,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501170,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501171,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,15.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501172,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501173,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501174,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501175,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501176,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,30.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501177,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501178,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501179,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,30.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501180,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,187.07243,[M-H]-,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501181,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501182,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501183,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501184,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,15.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501185,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,189.08698,[M+H]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501186,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,211.06893,[M+Na]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501187,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,211.06893,[M+Na]+,60.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501188,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,211.06893,[M+Na]+,30.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501189,CC(=O)N[C@@H](CCC(N)=O)C(=O)O,211.06893,[M+Na]+,20.0,val,CC(=O)N[C@@H](CCC(N)=O)C(=O)O
501190,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CN(C(C)C(=O)O)C1
501191,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CN(C(C)C(=O)O)C1
501192,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,60.0,val,CC1CN(C(C)C(=O)O)C1
501193,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,30.0,val,CC1CN(C(C)C(=O)O)C1
501194,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CN(C(C)C(=O)O)C1
501195,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,60.0,val,CC1CN(C(C)C(=O)O)C1
501196,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,30.0,val,CC1CN(C(C)C(=O)O)C1
501197,CC1CN(C(C)C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CN(C(C)C(=O)O)C1
501198,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,20.0,val,NC(C(=O)O)C1CCCC1
501199,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,20.0,val,NC(C(=O)O)C1CCCC1
501200,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,15.0,val,NC(C(=O)O)C1CCCC1
501201,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,60.0,val,NC(C(=O)O)C1CCCC1
501202,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,30.0,val,NC(C(=O)O)C1CCCC1
501203,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,20.0,val,NC(C(=O)O)C1CCCC1
501204,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,60.0,val,NC(C(=O)O)C1CCCC1
501205,NC(C(=O)O)C1CCCC1,144.1019,[M+H]+,20.0,val,NC(C(=O)O)C1CCCC1
501206,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,20.0,val,CC1(C(=O)O)CCCNC1
501207,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,20.0,val,CC1(C(=O)O)CCCNC1
501208,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,30.0,val,CC1(C(=O)O)CCCNC1
501209,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,60.0,val,CC1(C(=O)O)CCCNC1
501210,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,20.0,val,CC1(C(=O)O)CCCNC1
501211,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,45.0,val,CC1(C(=O)O)CCCNC1
501212,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,60.0,val,CC1(C(=O)O)CCCNC1
501213,CC1(C(=O)O)CCCNC1,144.1019,[M+H]+,20.0,val,CC1(C(=O)O)CCCNC1
501214,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CCNC(C(=O)O)C1
501215,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CCNC(C(=O)O)C1
501216,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,60.0,val,CC1CCNC(C(=O)O)C1
501217,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,30.0,val,CC1CCNC(C(=O)O)C1
501218,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CCNC(C(=O)O)C1
501219,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,60.0,val,CC1CCNC(C(=O)O)C1
501220,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,30.0,val,CC1CCNC(C(=O)O)C1
501221,CC1CCNC(C(=O)O)C1,144.1019,[M+H]+,20.0,val,CC1CCNC(C(=O)O)C1
501222,NC1(C(=O)O)CCCCC1,144.1019,[M+H]+,20.0,val,NC1(C(=O)O)CCCCC1
501223,NC1(C(=O)O)CCCCC1,144.1019,[M+H]+,20.0,val,NC1(C(=O)O)CCCCC1
501224,NC1(C(=O)O)CCCCC1,144.1019,[M+H]+,60.0,val,NC1(C(=O)O)CCCCC1
501225,NC1(C(=O)O)CCCCC1,144.1019,[M+H]+,30.0,val,NC1(C(=O)O)CCCCC1
501226,NC1(C(=O)O)CCCCC1,144.1019,[M+H]+,20.0,val,NC1(C(=O)O)CCCCC1
501227,CC(C1CC1)C(N)C(=O)O,144.1019,[M+H]+,20.0,val,CC(C1CC1)C(N)C(=O)O
501228,CC(C1CC1)C(N)C(=O)O,144.1019,[M+H]+,20.0,val,CC(C1CC1)C(N)C(=O)O
501229,CC(C1CC1)C(N)C(=O)O,144.1019,[M+H]+,60.0,val,CC(C1CC1)C(N)C(=O)O
501230,CC(C1CC1)C(N)C(=O)O,144.1019,[M+H]+,15.0,val,CC(C1CC1)C(N)C(=O)O
501231,CC(C1CC1)C(N)C(=O)O,144.1019,[M+H]+,20.0,val,CC(C1CC1)C(N)C(=O)O
501232,CCC1NCCC1C(=O)O,126.09134,[M+H-H2O]+,20.0,val,CCC1NCCC1C(=O)O
501233,CCC1NCCC1C(=O)O,126.09134,[M+H-H2O]+,20.0,val,CCC1NCCC1C(=O)O
501234,CCC1NCCC1C(=O)O,126.09134,[M+H-H2O]+,60.0,val,CCC1NCCC1C(=O)O
501235,CCC1NCCC1C(=O)O,126.09134,[M+H-H2O]+,30.0,val,CCC1NCCC1C(=O)O
501236,CCC1NCCC1C(=O)O,126.09134,[M+H-H2O]+,20.0,val,CCC1NCCC1C(=O)O
501237,CCC1NCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CCC1NCCC1C(=O)O
501238,CCC1NCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CCC1NCCC1C(=O)O
501239,CCC1NCCC1C(=O)O,144.1019,[M+H]+,60.0,val,CCC1NCCC1C(=O)O
501240,CCC1NCCC1C(=O)O,144.1019,[M+H]+,30.0,val,CCC1NCCC1C(=O)O
501241,CCC1NCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CCC1NCCC1C(=O)O
501242,CCC1NCCC1C(=O)O,144.1019,[M+H]+,60.0,val,CCC1NCCC1C(=O)O
501243,CCC1NCCC1C(=O)O,144.1019,[M+H]+,30.0,val,CCC1NCCC1C(=O)O
501244,CCC1NCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CCC1NCCC1C(=O)O
501245,NCC1(C(=O)O)CCCC1,126.09134,[M+H-H2O]+,30.0,val,NCC1(C(=O)O)CCCC1
501246,NCC1(C(=O)O)CCCC1,126.09134,[M+H-H2O]+,30.0,val,NCC1(C(=O)O)CCCC1
501247,NCC1(C(=O)O)CCCC1,126.09134,[M+H-H2O]+,20.0,val,NCC1(C(=O)O)CCCC1
501248,NCC1(C(=O)O)CCCC1,126.09134,[M+H-H2O]+,60.0,val,NCC1(C(=O)O)CCCC1
501249,NCC1(C(=O)O)CCCC1,126.09134,[M+H-H2O]+,30.0,val,NCC1(C(=O)O)CCCC1
501250,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,20.0,val,NCC1(C(=O)O)CCCC1
501251,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,20.0,val,NCC1(C(=O)O)CCCC1
501252,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,15.0,val,NCC1(C(=O)O)CCCC1
501253,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,60.0,val,NCC1(C(=O)O)CCCC1
501254,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,30.0,val,NCC1(C(=O)O)CCCC1
501255,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,20.0,val,NCC1(C(=O)O)CCCC1
501256,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,60.0,val,NCC1(C(=O)O)CCCC1
501257,NCC1(C(=O)O)CCCC1,144.1019,[M+H]+,20.0,val,NCC1(C(=O)O)CCCC1
501258,CC1NCCCC1C(=O)O,126.09134,[M+H-H2O]+,30.0,val,CC1NCCCC1C(=O)O
501259,CC1NCCCC1C(=O)O,126.09134,[M+H-H2O]+,30.0,val,CC1NCCCC1C(=O)O
501260,CC1NCCCC1C(=O)O,126.09134,[M+H-H2O]+,60.0,val,CC1NCCCC1C(=O)O
501261,CC1NCCCC1C(=O)O,126.09134,[M+H-H2O]+,20.0,val,CC1NCCCC1C(=O)O
501262,CC1NCCCC1C(=O)O,126.09134,[M+H-H2O]+,30.0,val,CC1NCCCC1C(=O)O
501263,CC1NCCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CC1NCCCC1C(=O)O
501264,CC1NCCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CC1NCCCC1C(=O)O
501265,CC1NCCCC1C(=O)O,144.1019,[M+H]+,30.0,val,CC1NCCCC1C(=O)O
501266,CC1NCCCC1C(=O)O,144.1019,[M+H]+,60.0,val,CC1NCCCC1C(=O)O
501267,CC1NCCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CC1NCCCC1C(=O)O
501268,CC1NCCCC1C(=O)O,144.1019,[M+H]+,45.0,val,CC1NCCCC1C(=O)O
501269,CC1NCCCC1C(=O)O,144.1019,[M+H]+,60.0,val,CC1NCCCC1C(=O)O
501270,CC1NCCCC1C(=O)O,144.1019,[M+H]+,20.0,val,CC1NCCCC1C(=O)O
501271,O=C(O)C1CCCCCN1,144.1019,[M+H]+,20.0,val,O=C(O)C1CCCCCN1
501272,O=C(O)C1CCCCCN1,144.1019,[M+H]+,20.0,val,O=C(O)C1CCCCCN1
501273,O=C(O)C1CCCCCN1,144.1019,[M+H]+,30.0,val,O=C(O)C1CCCCCN1
501274,O=C(O)C1CCCCCN1,144.1019,[M+H]+,60.0,val,O=C(O)C1CCCCCN1
501275,O=C(O)C1CCCCCN1,144.1019,[M+H]+,15.0,val,O=C(O)C1CCCCCN1
501276,O=C(O)C1CCCCCN1,144.1019,[M+H]+,20.0,val,O=C(O)C1CCCCCN1
501277,O=C(O)C1CCCCCN1,144.1019,[M+H]+,60.0,val,O=C(O)C1CCCCCN1
501278,O=C(O)C1CCCCCN1,144.1019,[M+H]+,20.0,val,O=C(O)C1CCCCCN1
501279,CN1CCCC[C@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@H]1C(=O)O
501280,CN1CCCC[C@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@H]1C(=O)O
501281,CN1CCCC[C@H]1C(=O)O,144.1019,[M+H]+,60.0,val,CN1CCCC[C@H]1C(=O)O
501282,CN1CCCC[C@H]1C(=O)O,144.1019,[M+H]+,15.0,val,CN1CCCC[C@H]1C(=O)O
501283,CN1CCCC[C@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@H]1C(=O)O
501284,O=C(O)CNC1CCCC1,144.1019,[M+H]+,20.0,val,O=C(O)CNC1CCCC1
501285,O=C(O)CNC1CCCC1,144.1019,[M+H]+,20.0,val,O=C(O)CNC1CCCC1
501286,O=C(O)CNC1CCCC1,144.1019,[M+H]+,60.0,val,O=C(O)CNC1CCCC1
501287,O=C(O)CNC1CCCC1,144.1019,[M+H]+,30.0,val,O=C(O)CNC1CCCC1
501288,O=C(O)CNC1CCCC1,144.1019,[M+H]+,20.0,val,O=C(O)CNC1CCCC1
501289,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,20.0,val,NC(CC1CCC1)C(=O)O
501290,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,20.0,val,NC(CC1CCC1)C(=O)O
501291,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,60.0,val,NC(CC1CCC1)C(=O)O
501292,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,15.0,val,NC(CC1CCC1)C(=O)O
501293,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,20.0,val,NC(CC1CCC1)C(=O)O
501294,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,60.0,val,NC(CC1CCC1)C(=O)O
501295,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,15.0,val,NC(CC1CCC1)C(=O)O
501296,NC(CC1CCC1)C(=O)O,144.1019,[M+H]+,20.0,val,NC(CC1CCC1)C(=O)O
501297,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@@H]1C(=O)O
501298,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@@H]1C(=O)O
501299,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,60.0,val,CN1CCCC[C@@H]1C(=O)O
501300,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,30.0,val,CN1CCCC[C@@H]1C(=O)O
501301,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@@H]1C(=O)O
501302,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,60.0,val,CN1CCCC[C@@H]1C(=O)O
501303,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,30.0,val,CN1CCCC[C@@H]1C(=O)O
501304,CN1CCCC[C@@H]1C(=O)O,144.1019,[M+H]+,20.0,val,CN1CCCC[C@@H]1C(=O)O
501305,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,20.0,val,CN(CC(=O)O)C1CCC1
501306,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,20.0,val,CN(CC(=O)O)C1CCC1
501307,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,60.0,val,CN(CC(=O)O)C1CCC1
501308,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,30.0,val,CN(CC(=O)O)C1CCC1
501309,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,20.0,val,CN(CC(=O)O)C1CCC1
501310,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,60.0,val,CN(CC(=O)O)C1CCC1
501311,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,30.0,val,CN(CC(=O)O)C1CCC1
501312,CN(CC(=O)O)C1CCC1,144.1019,[M+H]+,20.0,val,CN(CC(=O)O)C1CCC1
501313,C=C(C)C(=O)NCC(C)O,126.09134,[M+H-H2O]+,20.0,val,C=C(C)C(=O)NCC(C)O
501314,C=C(C)C(=O)NCC(C)O,126.09134,[M+H-H2O]+,20.0,val,C=C(C)C(=O)NCC(C)O
501315,C=C(C)C(=O)NCC(C)O,126.09134,[M+H-H2O]+,60.0,val,C=C(C)C(=O)NCC(C)O
501316,C=C(C)C(=O)NCC(C)O,126.09134,[M+H-H2O]+,30.0,val,C=C(C)C(=O)NCC(C)O
501317,C=C(C)C(=O)NCC(C)O,126.09134,[M+H-H2O]+,20.0,val,C=C(C)C(=O)NCC(C)O
501318,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,20.0,val,C=C(C)C(=O)NCC(C)O
501319,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,20.0,val,C=C(C)C(=O)NCC(C)O
501320,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,60.0,val,C=C(C)C(=O)NCC(C)O
501321,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,15.0,val,C=C(C)C(=O)NCC(C)O
501322,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,20.0,val,C=C(C)C(=O)NCC(C)O
501323,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,60.0,val,C=C(C)C(=O)NCC(C)O
501324,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,15.0,val,C=C(C)C(=O)NCC(C)O
501325,C=C(C)C(=O)NCC(C)O,144.1019,[M+H]+,20.0,val,C=C(C)C(=O)NCC(C)O
501326,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,223.0747,[M+H]+,20.0,val,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O
501327,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,223.0747,[M+H]+,20.0,val,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O
501328,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,223.0747,[M+H]+,60.0,val,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O
501329,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,223.0747,[M+H]+,15.0,val,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O
501330,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,223.0747,[M+H]+,20.0,val,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O
501331,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501332,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501333,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501334,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501335,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501336,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501337,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501338,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501339,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501340,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501341,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501342,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501343,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501344,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501345,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501346,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,20.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501347,C[N+]1(C)CCC[C@H]1C(=O)O,144.1019,[M]+,60.0,val,C[N+]1(C)CCC[C@H]1C(=O)O
501348,NCCCCNCCCN,146.16517,[M+H]+,20.0,val,NCCCCNCCCN
501349,NCCCCNCCCN,146.16517,[M+H]+,20.0,val,NCCCCNCCCN
501350,NCCCCNCCCN,146.16517,[M+H]+,60.0,val,NCCCCNCCCN
501351,NCCCCNCCCN,146.16517,[M+H]+,15.0,val,NCCCCNCCCN
501352,NCCCCNCCCN,146.16517,[M+H]+,20.0,val,NCCCCNCCCN
501353,O=C(O)c1cc2c(ncnc2Cl)s1,212.9531,[M-H]-,20.0,val,O=C(O)c1cc2c(Cl)ncnc2s1
501354,O=C(O)c1cc2c(ncnc2Cl)s1,212.9531,[M-H]-,20.0,val,O=C(O)c1cc2c(Cl)ncnc2s1
501355,O=C(O)c1cc2c(ncnc2Cl)s1,212.9531,[M-H]-,15.0,val,O=C(O)c1cc2c(Cl)ncnc2s1
501356,O=C(O)c1cc2c(ncnc2Cl)s1,212.9531,[M-H]-,60.0,val,O=C(O)c1cc2c(Cl)ncnc2s1
501357,O=C(O)c1cc2c(ncnc2Cl)s1,212.9531,[M-H]-,20.0,val,O=C(O)c1cc2c(Cl)ncnc2s1
501358,O=C(O)c1cnc2sccn2c1=O,178.99098,[M+H-H2O]+,30.0,val,O=C(O)c1cnc2sccn2c1=O
501359,O=C(O)c1cnc2sccn2c1=O,178.99098,[M+H-H2O]+,30.0,val,O=C(O)c1cnc2sccn2c1=O
501360,O=C(O)c1cnc2sccn2c1=O,178.99098,[M+H-H2O]+,20.0,val,O=C(O)c1cnc2sccn2c1=O
501361,O=C(O)c1cnc2sccn2c1=O,178.99098,[M+H-H2O]+,60.0,val,O=C(O)c1cnc2sccn2c1=O
501362,O=C(O)c1cnc2sccn2c1=O,178.99098,[M+H-H2O]+,30.0,val,O=C(O)c1cnc2sccn2c1=O
501363,O=C(O)c1cnc2sccn2c1=O,197.00154,[M+H]+,20.0,val,O=C(O)c1cnc2sccn2c1=O
501364,O=C(O)c1cnc2sccn2c1=O,197.00154,[M+H]+,20.0,val,O=C(O)c1cnc2sccn2c1=O
501365,O=C(O)c1cnc2sccn2c1=O,197.00154,[M+H]+,60.0,val,O=C(O)c1cnc2sccn2c1=O
501366,O=C(O)c1cnc2sccn2c1=O,197.00154,[M+H]+,20.0,val,O=C(O)c1cnc2sccn2c1=O
501367,O=C(O)c1cnc2sccn2c1=O,197.00154,[M+H]+,45.0,val,O=C(O)c1cnc2sccn2c1=O
501368,O=C(O)Cc1cc(C(F)(F)F)co1,193.0118,[M-H]-,20.0,val,O=C(O)Cc1cc(C(F)(F)F)co1
501369,O=C(O)Cc1cc(C(F)(F)F)co1,193.0118,[M-H]-,20.0,val,O=C(O)Cc1cc(C(F)(F)F)co1
501370,O=C(O)Cc1cc(C(F)(F)F)co1,193.0118,[M-H]-,60.0,val,O=C(O)Cc1cc(C(F)(F)F)co1
501371,O=C(O)Cc1cc(C(F)(F)F)co1,193.0118,[M-H]-,15.0,val,O=C(O)Cc1cc(C(F)(F)F)co1
501372,O=C(O)Cc1cc(C(F)(F)F)co1,193.0118,[M-H]-,20.0,val,O=C(O)Cc1cc(C(F)(F)F)co1
501373,Cc1cc(C(=O)O)c(C(F)(F)F)o1,193.0118,[M-H]-,15.0,val,Cc1cc(C(=O)O)c(C(F)(F)F)o1
501374,Cc1cc(C(=O)O)c(C(F)(F)F)o1,193.0118,[M-H]-,15.0,val,Cc1cc(C(=O)O)c(C(F)(F)F)o1
501375,Cc1cc(C(=O)O)c(C(F)(F)F)o1,193.0118,[M-H]-,20.0,val,Cc1cc(C(=O)O)c(C(F)(F)F)o1
501376,Cc1cc(C(=O)O)c(C(F)(F)F)o1,193.0118,[M-H]-,60.0,val,Cc1cc(C(=O)O)c(C(F)(F)F)o1
501377,Cc1cc(C(=O)O)c(C(F)(F)F)o1,193.0118,[M-H]-,15.0,val,Cc1cc(C(=O)O)c(C(F)(F)F)o1
501378,N#CSc1c(N)nc(N)c(SC#N)c1,224.00591,[M+H]+,20.0,val,N#CSc1cc(SC#N)c(N)nc1N
501379,N#CSc1c(N)nc(N)c(SC#N)c1,224.00591,[M+H]+,20.0,val,N#CSc1cc(SC#N)c(N)nc1N
501380,N#CSc1c(N)nc(N)c(SC#N)c1,224.00591,[M+H]+,60.0,val,N#CSc1cc(SC#N)c(N)nc1N
501381,N#CSc1c(N)nc(N)c(SC#N)c1,224.00591,[M+H]+,20.0,val,N#CSc1cc(SC#N)c(N)nc1N
501382,N#CSc1c(N)nc(N)c(SC#N)c1,224.00591,[M+H]+,45.0,val,N#CSc1cc(SC#N)c(N)nc1N
501383,COc1cc[nH]c(=O)c1C#N,149.03565,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C#N
501384,COc1cc[nH]c(=O)c1C#N,149.03565,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C#N
501385,COc1cc[nH]c(=O)c1C#N,149.03565,[M-H]-,45.0,val,COc1cc[nH]c(=O)c1C#N
501386,COc1cc[nH]c(=O)c1C#N,149.03565,[M-H]-,60.0,val,COc1cc[nH]c(=O)c1C#N
501387,COc1cc[nH]c(=O)c1C#N,149.03565,[M-H]-,20.0,val,COc1cc[nH]c(=O)c1C#N
501388,COc1cc[nH]c(=O)c1C#N,151.0502,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C#N
501389,COc1cc[nH]c(=O)c1C#N,151.0502,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C#N
501390,COc1cc[nH]c(=O)c1C#N,151.0502,[M+H]+,45.0,val,COc1cc[nH]c(=O)c1C#N
501391,COc1cc[nH]c(=O)c1C#N,151.0502,[M+H]+,60.0,val,COc1cc[nH]c(=O)c1C#N
501392,COc1cc[nH]c(=O)c1C#N,151.0502,[M+H]+,20.0,val,COc1cc[nH]c(=O)c1C#N
501393,CCc1c(Br)cc(C(=O)O)s1,232.92774,[M-H]-,20.0,val,CCc1sc(C(=O)O)cc1Br
501394,CCc1c(Br)cc(C(=O)O)s1,232.92774,[M-H]-,20.0,val,CCc1sc(C(=O)O)cc1Br
501395,CCc1c(Br)cc(C(=O)O)s1,232.92774,[M-H]-,60.0,val,CCc1sc(C(=O)O)cc1Br
501396,CCc1c(Br)cc(C(=O)O)s1,232.92774,[M-H]-,15.0,val,CCc1sc(C(=O)O)cc1Br
501397,CCc1c(Br)cc(C(=O)O)s1,232.92774,[M-H]-,20.0,val,CCc1sc(C(=O)O)cc1Br
501398,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,20.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501399,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,20.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501400,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,60.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501401,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,15.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501402,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,20.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501403,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,60.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501404,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,15.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501405,Cc1c(Cl)c(C(F)F)nn1CC(=O)O,223.00914,[M-H]-,20.0,val,Cc1c(Cl)c(C(F)F)nn1CC(=O)O
501406,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501407,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501408,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,60.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501409,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,30.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501410,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501411,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501412,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501413,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,60.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501414,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,30.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501415,NS(=O)(=O)c1ccc(C(=O)O)cc1,200.0023,[M-H]-,20.0,val,NS(=O)(=O)c1ccc(C(=O)O)cc1
501416,Cc1noc(Cl)c1CCC(=O)O,188.012,[M-H]-,20.0,val,Cc1noc(Cl)c1CCC(=O)O
501417,Cc1noc(Cl)c1CCC(=O)O,188.012,[M-H]-,20.0,val,Cc1noc(Cl)c1CCC(=O)O
501418,Cc1noc(Cl)c1CCC(=O)O,188.012,[M-H]-,60.0,val,Cc1noc(Cl)c1CCC(=O)O
501419,Cc1noc(Cl)c1CCC(=O)O,188.012,[M-H]-,15.0,val,Cc1noc(Cl)c1CCC(=O)O
501420,Cc1noc(Cl)c1CCC(=O)O,188.012,[M-H]-,20.0,val,Cc1noc(Cl)c1CCC(=O)O
501421,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,200.04769,[M-H]-,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501422,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,200.04769,[M-H]-,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501423,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,200.04769,[M-H]-,15.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501424,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,200.04769,[M-H]-,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501425,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501426,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501427,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,60.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501428,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501429,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,45.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501430,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,60.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501431,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501432,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,202.06224,[M+H]+,45.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501433,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,224.04419,[M+Na]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501434,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,224.04419,[M+Na]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501435,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,224.04419,[M+Na]+,60.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501436,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,224.04419,[M+Na]+,15.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501437,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1,224.04419,[M+Na]+,20.0,val,O=C(O)c1cn([C@@H]2COC[C@@H]2F)nn1
501438,CC(=O)N[C@H](Cc1cc2ccccc2cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cnccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O,1630.7488,[M]-,20.0,val,CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
501439,CC(=O)N[C@H](Cc1cc2ccccc2cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cnccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O,1630.7488,[M]-,20.0,val,CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
501440,CC(=O)N[C@H](Cc1cc2ccccc2cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cnccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O,1675.747,[M+FA]-,20.0,val,CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
501441,CC(=O)N[C@H](Cc1cc2ccccc2cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cnccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O,1675.747,[M+FA]-,60.0,val,CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O
501442,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501443,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501444,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,60.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501445,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,15.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501446,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501447,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,60.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501448,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,15.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501449,CCn1nc(C)c(C(=O)O)c1C(F)F,203.06376,[M-H]-,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501450,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501451,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501452,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,60.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501453,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,30.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501454,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501455,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,60.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501456,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,30.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501457,Cc1cc(C(F)F)nn1C(C)C(=O)O,203.06376,[M-H]-,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501458,Cc1nn(C(F)F)c(C)c1CC(=O)O,203.06376,[M-H]-,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501459,Cc1nn(C(F)F)c(C)c1CC(=O)O,203.06376,[M-H]-,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501460,Cc1nn(C(F)F)c(C)c1CC(=O)O,203.06376,[M-H]-,60.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501461,Cc1nn(C(F)F)c(C)c1CC(=O)O,203.06376,[M-H]-,15.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501462,Cc1nn(C(F)F)c(C)c1CC(=O)O,203.06376,[M-H]-,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501463,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501464,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501465,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,60.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501466,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,30.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501467,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501468,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,60.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501469,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,30.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501470,Cc1cc(C(F)F)nn1C(C)C(=O)O,205.07831,[M+H]+,20.0,val,Cc1cc(C(F)F)nn1C(C)C(=O)O
501471,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501472,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501473,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,60.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501474,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,15.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501475,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501476,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,45.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501477,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,60.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501478,Cc1nn(C(F)F)c(C)c1CC(=O)O,205.07831,[M+H]+,20.0,val,Cc1nn(C(F)F)c(C)c1CC(=O)O
501479,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501480,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501481,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,60.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501482,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,30.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501483,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501484,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,60.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501485,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,30.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501486,CCn1nc(C)c(C(=O)O)c1C(F)F,205.07831,[M+H]+,20.0,val,CCn1nc(C)c(C(=O)O)c1C(F)F
501487,NC(N)=NCc1cc(I)ccc1,309.96135,[M+Cl]-,20.0,val,NC(N)=NCc1cccc(I)c1
501488,NC(N)=NCc1cc(I)ccc1,309.96135,[M+Cl]-,20.0,val,NC(N)=NCc1cccc(I)c1
501489,NC(N)=NCc1cc(I)ccc1,319.99015,[M+FA]-,20.0,val,NC(N)=NCc1cccc(I)c1
501490,NC(N)=NCc1cc(I)ccc1,319.99015,[M+FA]-,20.0,val,NC(N)=NCc1cccc(I)c1
501491,NC(N)=NCc1cc(I)ccc1,319.99015,[M+FA]-,15.0,val,NC(N)=NCc1cccc(I)c1
501492,NC(N)=NCc1cc(I)ccc1,319.99015,[M+FA]-,20.0,val,NC(N)=NCc1cccc(I)c1
501493,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,20.0,val,NC(N)=NCc1cccc(I)c1
501494,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,20.0,val,NC(N)=NCc1cccc(I)c1
501495,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,60.0,val,NC(N)=NCc1cccc(I)c1
501496,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,30.0,val,NC(N)=NCc1cccc(I)c1
501497,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,20.0,val,NC(N)=NCc1cccc(I)c1
501498,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,45.0,val,NC(N)=NCc1cccc(I)c1
501499,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,60.0,val,NC(N)=NCc1cccc(I)c1
501500,NC(N)=NCc1cc(I)ccc1,275.99922,[M+H]+,20.0,val,NC(N)=NCc1cccc(I)c1
501501,Cn1cc(OC2(C(=O)O)CC2)cn1,181.06187,[M-H]-,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501502,Cn1cc(OC2(C(=O)O)CC2)cn1,181.06187,[M-H]-,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501503,Cn1cc(OC2(C(=O)O)CC2)cn1,181.06187,[M-H]-,60.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501504,Cn1cc(OC2(C(=O)O)CC2)cn1,181.06187,[M-H]-,30.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501505,Cn1cc(OC2(C(=O)O)CC2)cn1,181.06187,[M-H]-,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501506,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501507,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501508,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,60.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501509,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,30.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501510,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501511,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,60.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501512,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,30.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501513,Cn1cc(OC2(C(=O)O)CC2)cn1,183.07642,[M+H]+,20.0,val,Cn1cc(OC2(C(=O)O)CC2)cn1
501514,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,20.0,val,O=C(O)c1cn(C2CCOC2)cn1
501515,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,20.0,val,O=C(O)c1cn(C2CCOC2)cn1
501516,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,60.0,val,O=C(O)c1cn(C2CCOC2)cn1
501517,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,20.0,val,O=C(O)c1cn(C2CCOC2)cn1
501518,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,45.0,val,O=C(O)c1cn(C2CCOC2)cn1
501519,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,60.0,val,O=C(O)c1cn(C2CCOC2)cn1
501520,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,20.0,val,O=C(O)c1cn(C2CCOC2)cn1
501521,O=C(O)c1cn(C2CCOC2)cn1,183.07642,[M+H]+,45.0,val,O=C(O)c1cn(C2CCOC2)cn1
501522,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,20.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501523,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,20.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501524,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,60.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501525,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,15.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501526,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,20.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501527,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,45.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501528,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,60.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501529,Cc1nn(C)c(=O)c(C(=O)O)c1C,183.07642,[M+H]+,20.0,val,Cc1nn(C)c(=O)c(C(=O)O)c1C
501530,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,20.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501531,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,20.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501532,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,60.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501533,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,20.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501534,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,45.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501535,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,60.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501536,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,20.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501537,Cc1nc(=O)[nH]c(C)c1CC(=O)O,183.07642,[M+H]+,45.0,val,Cc1nc(=O)[nH]c(C)c1CC(=O)O
501538,OCCc1cc(O)c(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)c(O)c1
501539,OCCc1cc(O)c(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)c(O)c1
501540,OCCc1cc(O)c(O)cc1,153.05572,[M-H]-,60.0,val,OCCc1ccc(O)c(O)c1
501541,OCCc1cc(O)c(O)cc1,153.05572,[M-H]-,30.0,val,OCCc1ccc(O)c(O)c1
501542,OCCc1cc(O)c(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)c(O)c1
501543,OCCc1cc(O)c(O)cc1,189.0324,[M+Cl]-,20.0,val,OCCc1ccc(O)c(O)c1
501544,OCCc1cc(O)c(O)cc1,189.0324,[M+Cl]-,20.0,val,OCCc1ccc(O)c(O)c1
501545,OCCc1cc(O)c(O)cc1,189.0324,[M+Cl]-,60.0,val,OCCc1ccc(O)c(O)c1
501546,OCCc1cc(O)c(O)cc1,189.0324,[M+Cl]-,15.0,val,OCCc1ccc(O)c(O)c1
501547,OCCc1cc(O)c(O)cc1,189.0324,[M+Cl]-,20.0,val,OCCc1ccc(O)c(O)c1
501548,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501549,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501550,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,60.0,val,Cc1oc(=O)c(C)c(O)c1C
501551,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,30.0,val,Cc1oc(=O)c(C)c(O)c1C
501552,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501553,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,60.0,val,Cc1oc(=O)c(C)c(O)c1C
501554,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,30.0,val,Cc1oc(=O)c(C)c(O)c1C
501555,Cc1c(C)c(O)c(C)c(=O)o1,153.05572,[M-H]-,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501556,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O,153.05572,[M-H]-,20.0,val,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O
501557,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O,153.05572,[M-H]-,20.0,val,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O
501558,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O,153.05572,[M-H]-,60.0,val,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O
501559,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O,153.05572,[M-H]-,30.0,val,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O
501560,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O,153.05572,[M-H]-,20.0,val,C/C=C/C1=CC(=O)[C@H](O)[C@H]1O
501561,OCCc1c(O)cc(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)cc1O
501562,OCCc1c(O)cc(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)cc1O
501563,OCCc1c(O)cc(O)cc1,153.05572,[M-H]-,60.0,val,OCCc1ccc(O)cc1O
501564,OCCc1c(O)cc(O)cc1,153.05572,[M-H]-,30.0,val,OCCc1ccc(O)cc1O
501565,OCCc1c(O)cc(O)cc1,153.05572,[M-H]-,20.0,val,OCCc1ccc(O)cc1O
501566,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501567,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501568,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,60.0,val,Cc1oc(=O)c(C)c(O)c1C
501569,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501570,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,45.0,val,Cc1oc(=O)c(C)c(O)c1C
501571,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,60.0,val,Cc1oc(=O)c(C)c(O)c1C
501572,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,20.0,val,Cc1oc(=O)c(C)c(O)c1C
501573,Cc1c(C)c(O)c(C)c(=O)o1,155.07027,[M+H]+,45.0,val,Cc1oc(=O)c(C)c(O)c1C
501574,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501575,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501576,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,60.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501577,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,15.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501578,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501579,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,60.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501580,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,15.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501581,COC(C)c1nc(C)c(C(=O)O)s1,200.03869,[M-H]-,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501582,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501583,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501584,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,60.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501585,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,15.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501586,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501587,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,60.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501588,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,15.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501589,COC(C)c1nc(C)c(C(=O)O)s1,202.05324,[M+H]+,20.0,val,COC(C)c1nc(C)c(C(=O)O)s1
501590,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,273.08406,[M+FA]-,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501591,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,273.08406,[M+FA]-,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501592,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,273.08406,[M+FA]-,60.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501593,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,273.08406,[M+FA]-,15.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501594,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,273.08406,[M+FA]-,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501595,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,229.09313,[M+H]+,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501596,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,229.09313,[M+H]+,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501597,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,229.09313,[M+H]+,60.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501598,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,229.09313,[M+H]+,30.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501599,Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cn1,229.09313,[M+H]+,20.0,val,Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
501600,O=C(O)C1CC12CCS(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C1CC12CCS(=O)(=O)CC2
501601,O=C(O)C1CC12CCS(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C1CC12CCS(=O)(=O)CC2
501602,O=C(O)C1CC12CCS(=O)(=O)CC2,203.03835,[M-H]-,60.0,val,O=C(O)C1CC12CCS(=O)(=O)CC2
501603,O=C(O)C1CC12CCS(=O)(=O)CC2,203.03835,[M-H]-,30.0,val,O=C(O)C1CC12CCS(=O)(=O)CC2
501604,O=C(O)C1CC12CCS(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C1CC12CCS(=O)(=O)CC2
501605,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501606,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501607,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,60.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501608,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,30.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501609,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501610,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,60.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501611,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,30.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501612,O=C(O)C12CCC(C1)S(=O)(=O)CC2,203.03835,[M-H]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501613,O=C(O)C12CCC(C1)S(=O)(=O)CC2,239.01503,[M+Cl]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501614,O=C(O)C12CCC(C1)S(=O)(=O)CC2,239.01503,[M+Cl]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501615,O=C(O)C12CCC(C1)S(=O)(=O)CC2,239.01503,[M+Cl]-,60.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501616,O=C(O)C12CCC(C1)S(=O)(=O)CC2,239.01503,[M+Cl]-,15.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501617,O=C(O)C12CCC(C1)S(=O)(=O)CC2,239.01503,[M+Cl]-,20.0,val,O=C(O)C12CCC(C1)S(=O)(=O)CC2
501618,COC(=O)CC(O)(CC(=O)O)C(=O)OC,219.05103,[M-H]-,15.0,val,COC(=O)CC(O)(CC(=O)O)C(=O)OC
501619,COC(=O)CC(O)(CC(=O)O)C(=O)OC,219.05103,[M-H]-,15.0,val,COC(=O)CC(O)(CC(=O)O)C(=O)OC
501620,COC(=O)CC(O)(CC(=O)O)C(=O)OC,219.05103,[M-H]-,20.0,val,COC(=O)CC(O)(CC(=O)O)C(=O)OC
501621,COC(=O)CC(O)(CC(=O)O)C(=O)OC,219.05103,[M-H]-,60.0,val,COC(=O)CC(O)(CC(=O)O)C(=O)OC
501622,COC(=O)CC(O)(CC(=O)O)C(=O)OC,219.05103,[M-H]-,15.0,val,COC(=O)CC(O)(CC(=O)O)C(=O)OC
501623,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501624,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501625,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,60.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501626,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,30.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501627,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501628,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,60.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501629,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,30.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501630,CC(=O)N1CCC(C)(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501631,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501632,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501633,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,60.0,val,CC(=O)NC1(C(=O)O)CCCC1
501634,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,30.0,val,CC(=O)NC1(C(=O)O)CCCC1
501635,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501636,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,60.0,val,CC(=O)NC1(C(=O)O)CCCC1
501637,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,30.0,val,CC(=O)NC1(C(=O)O)CCCC1
501638,CC(=O)NC1(C(=O)O)CCCC1,170.08227,[M-H]-,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501639,CC(C)C1(C(=O)O)CNC(=O)C1,170.08227,[M-H]-,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501640,CC(C)C1(C(=O)O)CNC(=O)C1,170.08227,[M-H]-,30.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501641,CC(C)C1(C(=O)O)CNC(=O)C1,170.08227,[M-H]-,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501642,CC(C)C1(C(=O)O)CNC(=O)C1,170.08227,[M-H]-,30.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501643,CC(C)C1(C(=O)O)CNC(=O)C1,170.08227,[M-H]-,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501644,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501645,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501646,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,60.0,val,CC1(CCC(=O)O)CCC(=O)N1
501647,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501648,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501649,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,60.0,val,CC1(CCC(=O)O)CCC(=O)N1
501650,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501651,CC1(CCC(=O)O)CCC(=O)N1,170.08227,[M-H]-,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501652,O=C(O)CNC(=O)C1CCCC1,170.08227,[M-H]-,20.0,val,O=C(O)CNC(=O)C1CCCC1
501653,O=C(O)CNC(=O)C1CCCC1,170.08227,[M-H]-,20.0,val,O=C(O)CNC(=O)C1CCCC1
501654,O=C(O)CNC(=O)C1CCCC1,170.08227,[M-H]-,60.0,val,O=C(O)CNC(=O)C1CCCC1
501655,O=C(O)CNC(=O)C1CCCC1,170.08227,[M-H]-,30.0,val,O=C(O)CNC(=O)C1CCCC1
501656,O=C(O)CNC(=O)C1CCCC1,170.08227,[M-H]-,20.0,val,O=C(O)CNC(=O)C1CCCC1
501657,CC(NC(=O)C1CCC1)C(=O)O,170.08227,[M-H]-,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501658,CC(NC(=O)C1CCC1)C(=O)O,170.08227,[M-H]-,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501659,CC(NC(=O)C1CCC1)C(=O)O,170.08227,[M-H]-,60.0,val,CC(NC(=O)C1CCC1)C(=O)O
501660,CC(NC(=O)C1CCC1)C(=O)O,170.08227,[M-H]-,30.0,val,CC(NC(=O)C1CCC1)C(=O)O
501661,CC(NC(=O)C1CCC1)C(=O)O,170.08227,[M-H]-,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501662,CCN1C(=O)CCC1CC(=O)O,170.08227,[M-H]-,20.0,val,CCN1C(=O)CCC1CC(=O)O
501663,CCN1C(=O)CCC1CC(=O)O,170.08227,[M-H]-,20.0,val,CCN1C(=O)CCC1CC(=O)O
501664,CCN1C(=O)CCC1CC(=O)O,170.08227,[M-H]-,30.0,val,CCN1C(=O)CCC1CC(=O)O
501665,CCN1C(=O)CCC1CC(=O)O,170.08227,[M-H]-,20.0,val,CCN1C(=O)CCC1CC(=O)O
501666,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501667,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501668,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,60.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501669,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,30.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501670,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501671,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,60.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501672,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,30.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501673,CC(=O)NC(C)(C(=O)O)C1CC1,170.08227,[M-H]-,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501674,O=C(O)CC1CCCCC(=O)N1,170.08227,[M-H]-,20.0,val,O=C(O)CC1CCCCC(=O)N1
501675,O=C(O)CC1CCCCC(=O)N1,170.08227,[M-H]-,20.0,val,O=C(O)CC1CCCCC(=O)N1
501676,O=C(O)CC1CCCCC(=O)N1,170.08227,[M-H]-,60.0,val,O=C(O)CC1CCCCC(=O)N1
501677,O=C(O)CC1CCCCC(=O)N1,170.08227,[M-H]-,30.0,val,O=C(O)CC1CCCCC(=O)N1
501678,O=C(O)CC1CCCCC(=O)N1,170.08227,[M-H]-,20.0,val,O=C(O)CC1CCCCC(=O)N1
501679,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501680,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501681,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,30.0,val,CC(C)N1CC(C(=O)O)CC1=O
501682,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501683,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,30.0,val,CC(C)N1CC(C(=O)O)CC1=O
501684,CC(C)N1CC(C(=O)O)CC1=O,170.08227,[M-H]-,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501685,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501686,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501687,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,30.0,val,CN1CC(C)(C(=O)O)CCC1=O
501688,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501689,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,30.0,val,CN1CC(C)(C(=O)O)CCC1=O
501690,CN1CC(C)(C(=O)O)CCC1=O,170.08227,[M-H]-,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501691,CC(=O)N1CCCCC1C(=O)O,170.08227,[M-H]-,20.0,val,CC(=O)N1CCCCC1C(=O)O
501692,CC(=O)N1CCCCC1C(=O)O,170.08227,[M-H]-,20.0,val,CC(=O)N1CCCCC1C(=O)O
501693,CC(=O)N1CCCCC1C(=O)O,170.08227,[M-H]-,30.0,val,CC(=O)N1CCCCC1C(=O)O
501694,CC(=O)N1CCCCC1C(=O)O,170.08227,[M-H]-,20.0,val,CC(=O)N1CCCCC1C(=O)O
501695,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501696,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501697,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,60.0,val,CCC(=O)N1CCC(C(=O)O)C1
501698,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,30.0,val,CCC(=O)N1CCC(C(=O)O)C1
501699,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501700,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,60.0,val,CCC(=O)N1CCC(C(=O)O)C1
501701,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,30.0,val,CCC(=O)N1CCC(C(=O)O)C1
501702,CCC(=O)N1CCC(C(=O)O)C1,170.08227,[M-H]-,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501703,CCC(=O)N1CCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501704,CCC(=O)N1CCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501705,CCC(=O)N1CCC(C(=O)O)C1,172.09682,[M+H]+,60.0,val,CCC(=O)N1CCC(C(=O)O)C1
501706,CCC(=O)N1CCC(C(=O)O)C1,172.09682,[M+H]+,30.0,val,CCC(=O)N1CCC(C(=O)O)C1
501707,CCC(=O)N1CCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CCC(=O)N1CCC(C(=O)O)C1
501708,CC(NC(=O)C1CCC1)C(=O)O,172.09682,[M+H]+,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501709,CC(NC(=O)C1CCC1)C(=O)O,172.09682,[M+H]+,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501710,CC(NC(=O)C1CCC1)C(=O)O,172.09682,[M+H]+,60.0,val,CC(NC(=O)C1CCC1)C(=O)O
501711,CC(NC(=O)C1CCC1)C(=O)O,172.09682,[M+H]+,15.0,val,CC(NC(=O)C1CCC1)C(=O)O
501712,CC(NC(=O)C1CCC1)C(=O)O,172.09682,[M+H]+,20.0,val,CC(NC(=O)C1CCC1)C(=O)O
501713,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,20.0,val,O=C(O)CNC(=O)C1CCCC1
501714,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,20.0,val,O=C(O)CNC(=O)C1CCCC1
501715,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,60.0,val,O=C(O)CNC(=O)C1CCCC1
501716,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,15.0,val,O=C(O)CNC(=O)C1CCCC1
501717,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,20.0,val,O=C(O)CNC(=O)C1CCCC1
501718,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,60.0,val,O=C(O)CNC(=O)C1CCCC1
501719,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,15.0,val,O=C(O)CNC(=O)C1CCCC1
501720,O=C(O)CNC(=O)C1CCCC1,172.09682,[M+H]+,20.0,val,O=C(O)CNC(=O)C1CCCC1
501721,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501722,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501723,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501724,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501725,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501726,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501727,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501728,CC(=O)N1CCC(C)(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C)(C(=O)O)C1
501729,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)O)CC1
501730,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)O)CC1
501731,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCC(C(=O)O)CC1
501732,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCC(C(=O)O)CC1
501733,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)O)CC1
501734,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCC(C(=O)O)CC1
501735,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCC(C(=O)O)CC1
501736,CC(=O)N1CCC(C(=O)O)CC1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCC(C(=O)O)CC1
501737,CC(=O)NC1(C(=O)O)CCCC1,172.09682,[M+H]+,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501738,CC(=O)NC1(C(=O)O)CCCC1,172.09682,[M+H]+,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501739,CC(=O)NC1(C(=O)O)CCCC1,172.09682,[M+H]+,60.0,val,CC(=O)NC1(C(=O)O)CCCC1
501740,CC(=O)NC1(C(=O)O)CCCC1,172.09682,[M+H]+,15.0,val,CC(=O)NC1(C(=O)O)CCCC1
501741,CC(=O)NC1(C(=O)O)CCCC1,172.09682,[M+H]+,20.0,val,CC(=O)NC1(C(=O)O)CCCC1
501742,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501743,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501744,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,30.0,val,CN1CC(C)(C(=O)O)CCC1=O
501745,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,60.0,val,CN1CC(C)(C(=O)O)CCC1=O
501746,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,15.0,val,CN1CC(C)(C(=O)O)CCC1=O
501747,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501748,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,60.0,val,CN1CC(C)(C(=O)O)CCC1=O
501749,CN1CC(C)(C(=O)O)CCC1=O,172.09682,[M+H]+,20.0,val,CN1CC(C)(C(=O)O)CCC1=O
501750,O=C(O)CN1CCCCCC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CN1CCCCCC1=O
501751,O=C(O)CN1CCCCCC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CN1CCCCCC1=O
501752,O=C(O)CN1CCCCCC1=O,172.09682,[M+H]+,60.0,val,O=C(O)CN1CCCCCC1=O
501753,O=C(O)CN1CCCCCC1=O,172.09682,[M+H]+,15.0,val,O=C(O)CN1CCCCCC1=O
501754,O=C(O)CN1CCCCCC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CN1CCCCCC1=O
501755,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CCC(C(=O)O)N1CCCC1=O
501756,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CCC(C(=O)O)N1CCCC1=O
501757,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,30.0,val,CCC(C(=O)O)N1CCCC1=O
501758,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,60.0,val,CCC(C(=O)O)N1CCCC1=O
501759,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,15.0,val,CCC(C(=O)O)N1CCCC1=O
501760,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CCC(C(=O)O)N1CCCC1=O
501761,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,60.0,val,CCC(C(=O)O)N1CCCC1=O
501762,CCC(C(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CCC(C(=O)O)N1CCCC1=O
501763,O=C(O)CC1CCCCNC1=O,154.08626,[M+H-H2O]+,20.0,val,O=C(O)CC1CCCCNC1=O
501764,O=C(O)CC1CCCCNC1=O,154.08626,[M+H-H2O]+,20.0,val,O=C(O)CC1CCCCNC1=O
501765,O=C(O)CC1CCCCNC1=O,154.08626,[M+H-H2O]+,60.0,val,O=C(O)CC1CCCCNC1=O
501766,O=C(O)CC1CCCCNC1=O,154.08626,[M+H-H2O]+,20.0,val,O=C(O)CC1CCCCNC1=O
501767,O=C(O)CC1CCCCNC1=O,154.08626,[M+H-H2O]+,45.0,val,O=C(O)CC1CCCCNC1=O
501768,O=C(O)CC1CCCCNC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCNC1=O
501769,O=C(O)CC1CCCCNC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCNC1=O
501770,O=C(O)CC1CCCCNC1=O,172.09682,[M+H]+,60.0,val,O=C(O)CC1CCCCNC1=O
501771,O=C(O)CC1CCCCNC1=O,172.09682,[M+H]+,15.0,val,O=C(O)CC1CCCCNC1=O
501772,O=C(O)CC1CCCCNC1=O,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCNC1=O
501773,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,20.0,val,CC(C(=O)O)N1CCCCC1=O
501774,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,20.0,val,CC(C(=O)O)N1CCCCC1=O
501775,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,30.0,val,CC(C(=O)O)N1CCCCC1=O
501776,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,60.0,val,CC(C(=O)O)N1CCCCC1=O
501777,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,15.0,val,CC(C(=O)O)N1CCCCC1=O
501778,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,20.0,val,CC(C(=O)O)N1CCCCC1=O
501779,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,60.0,val,CC(C(=O)O)N1CCCCC1=O
501780,CC(C(=O)O)N1CCCCC1=O,172.09682,[M+H]+,20.0,val,CC(C(=O)O)N1CCCCC1=O
501781,CC(=O)N1CCCC(C(=O)O)C1,154.08626,[M+H-H2O]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501782,CC(=O)N1CCCC(C(=O)O)C1,154.08626,[M+H-H2O]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501783,CC(=O)N1CCCC(C(=O)O)C1,154.08626,[M+H-H2O]+,60.0,val,CC(=O)N1CCCC(C(=O)O)C1
501784,CC(=O)N1CCCC(C(=O)O)C1,154.08626,[M+H-H2O]+,30.0,val,CC(=O)N1CCCC(C(=O)O)C1
501785,CC(=O)N1CCCC(C(=O)O)C1,154.08626,[M+H-H2O]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501786,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501787,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501788,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCCC(C(=O)O)C1
501789,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCCC(C(=O)O)C1
501790,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501791,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,60.0,val,CC(=O)N1CCCC(C(=O)O)C1
501792,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,30.0,val,CC(=O)N1CCCC(C(=O)O)C1
501793,CC(=O)N1CCCC(C(=O)O)C1,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501794,CC(=O)N1CCCC(C(=O)O)C1,194.07876,[M+Na]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501795,CC(=O)N1CCCC(C(=O)O)C1,194.07876,[M+Na]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501796,CC(=O)N1CCCC(C(=O)O)C1,194.07876,[M+Na]+,60.0,val,CC(=O)N1CCCC(C(=O)O)C1
501797,CC(=O)N1CCCC(C(=O)O)C1,194.07876,[M+Na]+,30.0,val,CC(=O)N1CCCC(C(=O)O)C1
501798,CC(=O)N1CCCC(C(=O)O)C1,194.07876,[M+Na]+,20.0,val,CC(=O)N1CCCC(C(=O)O)C1
501799,CC(C)C1(C(=O)O)CNC(=O)C1,172.09682,[M+H]+,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501800,CC(C)C1(C(=O)O)CNC(=O)C1,172.09682,[M+H]+,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501801,CC(C)C1(C(=O)O)CNC(=O)C1,172.09682,[M+H]+,60.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501802,CC(C)C1(C(=O)O)CNC(=O)C1,172.09682,[M+H]+,30.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501803,CC(C)C1(C(=O)O)CNC(=O)C1,172.09682,[M+H]+,20.0,val,CC(C)C1(C(=O)O)CNC(=O)C1
501804,CC1(CCC(=O)O)CCC(=O)N1,154.08626,[M+H-H2O]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501805,CC1(CCC(=O)O)CCC(=O)N1,154.08626,[M+H-H2O]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501806,CC1(CCC(=O)O)CCC(=O)N1,154.08626,[M+H-H2O]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501807,CC1(CCC(=O)O)CCC(=O)N1,154.08626,[M+H-H2O]+,60.0,val,CC1(CCC(=O)O)CCC(=O)N1
501808,CC1(CCC(=O)O)CCC(=O)N1,154.08626,[M+H-H2O]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501809,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501810,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501811,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,60.0,val,CC1(CCC(=O)O)CCC(=O)N1
501812,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501813,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501814,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,60.0,val,CC1(CCC(=O)O)CCC(=O)N1
501815,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501816,CC1(CCC(=O)O)CCC(=O)N1,172.09682,[M+H]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501817,CC1(CCC(=O)O)CCC(=O)N1,194.07876,[M+Na]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501818,CC1(CCC(=O)O)CCC(=O)N1,194.07876,[M+Na]+,30.0,val,CC1(CCC(=O)O)CCC(=O)N1
501819,CC1(CCC(=O)O)CCC(=O)N1,194.07876,[M+Na]+,20.0,val,CC1(CCC(=O)O)CCC(=O)N1
501820,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCC(=O)N1
501821,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCC(=O)N1
501822,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,60.0,val,O=C(O)CC1CCCCC(=O)N1
501823,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,30.0,val,O=C(O)CC1CCCCC(=O)N1
501824,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCC(=O)N1
501825,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,60.0,val,O=C(O)CC1CCCCC(=O)N1
501826,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,30.0,val,O=C(O)CC1CCCCC(=O)N1
501827,O=C(O)CC1CCCCC(=O)N1,172.09682,[M+H]+,20.0,val,O=C(O)CC1CCCCC(=O)N1
501828,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,20.0,val,CCN1C(=O)CCC1CC(=O)O
501829,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,20.0,val,CCN1C(=O)CCC1CC(=O)O
501830,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,60.0,val,CCN1C(=O)CCC1CC(=O)O
501831,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,30.0,val,CCN1C(=O)CCC1CC(=O)O
501832,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,20.0,val,CCN1C(=O)CCC1CC(=O)O
501833,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,60.0,val,CCN1C(=O)CCC1CC(=O)O
501834,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,30.0,val,CCN1C(=O)CCC1CC(=O)O
501835,CCN1C(=O)CCC1CC(=O)O,172.09682,[M+H]+,20.0,val,CCN1C(=O)CCC1CC(=O)O
501836,CC(=O)NC(C)(C(=O)O)C1CC1,172.09682,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501837,CC(=O)NC(C)(C(=O)O)C1CC1,172.09682,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501838,CC(=O)NC(C)(C(=O)O)C1CC1,172.09682,[M+H]+,60.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501839,CC(=O)NC(C)(C(=O)O)C1CC1,172.09682,[M+H]+,15.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501840,CC(=O)NC(C)(C(=O)O)C1CC1,172.09682,[M+H]+,20.0,val,CC(=O)NC(C)(C(=O)O)C1CC1
501841,CC(C)N1CC(C(=O)O)CC1=O,172.09682,[M+H]+,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501842,CC(C)N1CC(C(=O)O)CC1=O,172.09682,[M+H]+,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501843,CC(C)N1CC(C(=O)O)CC1=O,172.09682,[M+H]+,60.0,val,CC(C)N1CC(C(=O)O)CC1=O
501844,CC(C)N1CC(C(=O)O)CC1=O,172.09682,[M+H]+,15.0,val,CC(C)N1CC(C(=O)O)CC1=O
501845,CC(C)N1CC(C(=O)O)CC1=O,172.09682,[M+H]+,20.0,val,CC(C)N1CC(C(=O)O)CC1=O
501846,CC(CC(=O)O)N1CCCC1=O,154.08626,[M+H-H2O]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501847,CC(CC(=O)O)N1CCCC1=O,154.08626,[M+H-H2O]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501848,CC(CC(=O)O)N1CCCC1=O,154.08626,[M+H-H2O]+,60.0,val,CC(CC(=O)O)N1CCCC1=O
501849,CC(CC(=O)O)N1CCCC1=O,154.08626,[M+H-H2O]+,15.0,val,CC(CC(=O)O)N1CCCC1=O
501850,CC(CC(=O)O)N1CCCC1=O,154.08626,[M+H-H2O]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501851,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501852,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501853,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,15.0,val,CC(CC(=O)O)N1CCCC1=O
501854,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,60.0,val,CC(CC(=O)O)N1CCCC1=O
501855,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,30.0,val,CC(CC(=O)O)N1CCCC1=O
501856,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501857,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,60.0,val,CC(CC(=O)O)N1CCCC1=O
501858,CC(CC(=O)O)N1CCCC1=O,172.09682,[M+H]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501859,CC(CC(=O)O)N1CCCC1=O,194.07876,[M+Na]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501860,CC(CC(=O)O)N1CCCC1=O,194.07876,[M+Na]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501861,CC(CC(=O)O)N1CCCC1=O,194.07876,[M+Na]+,60.0,val,CC(CC(=O)O)N1CCCC1=O
501862,CC(CC(=O)O)N1CCCC1=O,194.07876,[M+Na]+,30.0,val,CC(CC(=O)O)N1CCCC1=O
501863,CC(CC(=O)O)N1CCCC1=O,194.07876,[M+Na]+,20.0,val,CC(CC(=O)O)N1CCCC1=O
501864,CC(=O)N1CCCCC1C(=O)O,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCCC1C(=O)O
501865,CC(=O)N1CCCCC1C(=O)O,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCCC1C(=O)O
501866,CC(=O)N1CCCCC1C(=O)O,172.09682,[M+H]+,60.0,val,CC(=O)N1CCCCC1C(=O)O
501867,CC(=O)N1CCCCC1C(=O)O,172.09682,[M+H]+,15.0,val,CC(=O)N1CCCCC1C(=O)O
501868,CC(=O)N1CCCCC1C(=O)O,172.09682,[M+H]+,20.0,val,CC(=O)N1CCCCC1C(=O)O
501869,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,218.04925,[M-H]-,20.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501870,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,218.04925,[M-H]-,20.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501871,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,218.04925,[M-H]-,60.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501872,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,218.04925,[M-H]-,15.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501873,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,218.04925,[M-H]-,20.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501874,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,220.06381,[M+H]+,30.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501875,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,220.06381,[M+H]+,30.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501876,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,220.06381,[M+H]+,20.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501877,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,220.06381,[M+H]+,60.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501878,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2,220.06381,[M+H]+,30.0,val,C[C@]12CCCN1S(=O)(=O)[C@H](C(=O)O)C2
501879,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,20.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501880,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,20.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501881,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,60.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501882,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,30.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501883,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,20.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501884,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,30.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501885,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,60.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501886,CCOP(=O)(Cc1csc(N)n1)OCC,251.06138,[M+H]+,20.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501887,CCOP(=O)(Cc1csc(N)n1)OCC,273.04332,[M+Na]+,30.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501888,CCOP(=O)(Cc1csc(N)n1)OCC,273.04332,[M+Na]+,30.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501889,CCOP(=O)(Cc1csc(N)n1)OCC,273.04332,[M+Na]+,20.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501890,CCOP(=O)(Cc1csc(N)n1)OCC,273.04332,[M+Na]+,60.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501891,CCOP(=O)(Cc1csc(N)n1)OCC,273.04332,[M+Na]+,30.0,val,CCOP(=O)(Cc1csc(N)n1)OCC
501892,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1C2CCC1CC(O)C2
501893,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1C2CCC1CC(O)C2
501894,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1C2CCC1CC(O)C2
501895,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1C2CCC1CC(O)C2
501896,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1C2CCC1CC(O)C2
501897,CN1C2CCC1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1C2CCC1CC(O)C2
501898,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501899,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501900,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501901,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501902,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501903,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501904,CN1[C@@H]2CC[C@H]1CC(O)C2,124.11208,[M+H-H2O]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501905,CN1[C@@H]2CC[C@H]1CC(O)C2,124.11208,[M+H-H2O]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501906,CN1[C@@H]2CC[C@H]1CC(O)C2,124.11208,[M+H-H2O]+,45.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501907,CN1[C@@H]2CC[C@H]1CC(O)C2,124.11208,[M+H-H2O]+,60.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501908,CN1[C@@H]2CC[C@H]1CC(O)C2,124.11208,[M+H-H2O]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501909,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501910,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501911,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,45.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501912,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501913,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501914,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,20.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501915,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,45.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501916,CN1[C@@H]2CC[C@H]1CC(O)C2,142.12264,[M+H]+,60.0,val,CN1[C@@H]2CC[C@H]1CC(O)C2
501917,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)NC1C
501918,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)NC1C
501919,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,30.0,val,CC1CCC(C(=O)O)NC1C
501920,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,60.0,val,CC1CCC(C(=O)O)NC1C
501921,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)NC1C
501922,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,45.0,val,CC1CCC(C(=O)O)NC1C
501923,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,60.0,val,CC1CCC(C(=O)O)NC1C
501924,CC1CCC(C(=O)O)NC1C,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)NC1C
501925,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,20.0,val,CC1CCC(C)N1CC(=O)O
501926,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,20.0,val,CC1CCC(C)N1CC(=O)O
501927,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,60.0,val,CC1CCC(C)N1CC(=O)O
501928,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,30.0,val,CC1CCC(C)N1CC(=O)O
501929,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,20.0,val,CC1CCC(C)N1CC(=O)O
501930,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,60.0,val,CC1CCC(C)N1CC(=O)O
501931,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,30.0,val,CC1CCC(C)N1CC(=O)O
501932,CC1CCC(C)N1CC(=O)O,158.11755,[M+H]+,20.0,val,CC1CCC(C)N1CC(=O)O
501933,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,20.0,val,CC(NC1CCCC1)C(=O)O
501934,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,20.0,val,CC(NC1CCCC1)C(=O)O
501935,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,60.0,val,CC(NC1CCCC1)C(=O)O
501936,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,30.0,val,CC(NC1CCCC1)C(=O)O
501937,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,20.0,val,CC(NC1CCCC1)C(=O)O
501938,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,60.0,val,CC(NC1CCCC1)C(=O)O
501939,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,30.0,val,CC(NC1CCCC1)C(=O)O
501940,CC(NC1CCCC1)C(=O)O,158.11755,[M+H]+,20.0,val,CC(NC1CCCC1)C(=O)O
501941,NC1(C(=O)O)CCCCCC1,158.11755,[M+H]+,20.0,val,NC1(C(=O)O)CCCCCC1
501942,NC1(C(=O)O)CCCCCC1,158.11755,[M+H]+,20.0,val,NC1(C(=O)O)CCCCCC1
501943,NC1(C(=O)O)CCCCCC1,158.11755,[M+H]+,60.0,val,NC1(C(=O)O)CCCCCC1
501944,NC1(C(=O)O)CCCCCC1,158.11755,[M+H]+,30.0,val,NC1(C(=O)O)CCCCCC1
501945,NC1(C(=O)O)CCCCCC1,158.11755,[M+H]+,20.0,val,NC1(C(=O)O)CCCCCC1
501946,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCCC1CC(=O)O
501947,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCCC1CC(=O)O
501948,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,60.0,val,CN1CCCCC1CC(=O)O
501949,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,30.0,val,CN1CCCCC1CC(=O)O
501950,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCCC1CC(=O)O
501951,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,60.0,val,CN1CCCCC1CC(=O)O
501952,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,30.0,val,CN1CCCCC1CC(=O)O
501953,CN1CCCCC1CC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCCC1CC(=O)O
501954,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)O
501955,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)O
501956,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,60.0,val,CC1(C)CCCNC1C(=O)O
501957,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,30.0,val,CC1(C)CCCNC1C(=O)O
501958,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)O
501959,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,60.0,val,CC1(C)CCCNC1C(=O)O
501960,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,30.0,val,CC1(C)CCCNC1C(=O)O
501961,CC1(C)CCCNC1C(=O)O,158.11755,[M+H]+,20.0,val,CC1(C)CCCNC1C(=O)O
501962,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,45.0,val,CC1CCN(CC(=O)O)CC1
501963,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,45.0,val,CC1CCN(CC(=O)O)CC1
501964,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,30.0,val,CC1CCN(CC(=O)O)CC1
501965,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,20.0,val,CC1CCN(CC(=O)O)CC1
501966,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,60.0,val,CC1CCN(CC(=O)O)CC1
501967,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,45.0,val,CC1CCN(CC(=O)O)CC1
501968,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,20.0,val,CC1CCN(CC(=O)O)CC1
501969,CC1CCN(CC(=O)O)CC1,158.11755,[M+H]+,60.0,val,CC1CCN(CC(=O)O)CC1
501970,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,20.0,val,O=C(O)CNC1CCCCC1
501971,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,20.0,val,O=C(O)CNC1CCCCC1
501972,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,60.0,val,O=C(O)CNC1CCCCC1
501973,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,30.0,val,O=C(O)CNC1CCCCC1
501974,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,20.0,val,O=C(O)CNC1CCCCC1
501975,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,60.0,val,O=C(O)CNC1CCCCC1
501976,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,30.0,val,O=C(O)CNC1CCCCC1
501977,O=C(O)CNC1CCCCC1,158.11755,[M+H]+,20.0,val,O=C(O)CNC1CCCCC1
501978,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,CN(C)C1(C(=O)O)CCCC1
501979,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,CN(C)C1(C(=O)O)CCCC1
501980,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,60.0,val,CN(C)C1(C(=O)O)CCCC1
501981,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,30.0,val,CN(C)C1(C(=O)O)CCCC1
501982,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,CN(C)C1(C(=O)O)CCCC1
501983,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,60.0,val,CN(C)C1(C(=O)O)CCCC1
501984,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,30.0,val,CN(C)C1(C(=O)O)CCCC1
501985,CN(C)C1(C(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,CN(C)C1(C(=O)O)CCCC1
501986,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,20.0,val,CC(C)(C)N1CCC1C(=O)O
501987,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,20.0,val,CC(C)(C)N1CCC1C(=O)O
501988,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,30.0,val,CC(C)(C)N1CCC1C(=O)O
501989,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,60.0,val,CC(C)(C)N1CCC1C(=O)O
501990,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,15.0,val,CC(C)(C)N1CCC1C(=O)O
501991,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,20.0,val,CC(C)(C)N1CCC1C(=O)O
501992,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,60.0,val,CC(C)(C)N1CCC1C(=O)O
501993,CC(C)(C)N1CCC1C(=O)O,158.11755,[M+H]+,20.0,val,CC(C)(C)N1CCC1C(=O)O
501994,CC1CCC(C(=O)O)C(C)N1,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)C(C)N1
501995,CC1CCC(C(=O)O)C(C)N1,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)C(C)N1
501996,CC1CCC(C(=O)O)C(C)N1,158.11755,[M+H]+,60.0,val,CC1CCC(C(=O)O)C(C)N1
501997,CC1CCC(C(=O)O)C(C)N1,158.11755,[M+H]+,30.0,val,CC1CCC(C(=O)O)C(C)N1
501998,CC1CCC(C(=O)O)C(C)N1,158.11755,[M+H]+,20.0,val,CC1CCC(C(=O)O)C(C)N1
501999,CC1CCC(N)(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,CC1CCC(N)(C(=O)O)CC1
502000,CC1CCC(N)(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,CC1CCC(N)(C(=O)O)CC1
502001,CC1CCC(N)(C(=O)O)CC1,158.11755,[M+H]+,60.0,val,CC1CCC(N)(C(=O)O)CC1
502002,CC1CCC(N)(C(=O)O)CC1,158.11755,[M+H]+,15.0,val,CC1CCC(N)(C(=O)O)CC1
502003,CC1CCC(N)(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,CC1CCC(N)(C(=O)O)CC1
502004,CC1CCCC(N)(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1CCCC(N)(C(=O)O)C1
502005,CC1CCCC(N)(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1CCCC(N)(C(=O)O)C1
502006,CC1CCCC(N)(C(=O)O)C1,158.11755,[M+H]+,60.0,val,CC1CCCC(N)(C(=O)O)C1
502007,CC1CCCC(N)(C(=O)O)C1,158.11755,[M+H]+,15.0,val,CC1CCCC(N)(C(=O)O)C1
502008,CC1CCCC(N)(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1CCCC(N)(C(=O)O)C1
502009,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1(C)CCNC(C(=O)O)C1
502010,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1(C)CCNC(C(=O)O)C1
502011,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,60.0,val,CC1(C)CCNC(C(=O)O)C1
502012,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,30.0,val,CC1(C)CCNC(C(=O)O)C1
502013,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1(C)CCNC(C(=O)O)C1
502014,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,60.0,val,CC1(C)CCNC(C(=O)O)C1
502015,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,30.0,val,CC1(C)CCNC(C(=O)O)C1
502016,CC1(C)CCNC(C(=O)O)C1,158.11755,[M+H]+,20.0,val,CC1(C)CCNC(C(=O)O)C1
502017,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,20.0,val,CC1CCCCC1(N)C(=O)O
502018,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,20.0,val,CC1CCCCC1(N)C(=O)O
502019,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,15.0,val,CC1CCCCC1(N)C(=O)O
502020,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,60.0,val,CC1CCCCC1(N)C(=O)O
502021,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,30.0,val,CC1CCCCC1(N)C(=O)O
502022,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,20.0,val,CC1CCCCC1(N)C(=O)O
502023,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,60.0,val,CC1CCCCC1(N)C(=O)O
502024,CC1CCCCC1(N)C(=O)O,158.11755,[M+H]+,20.0,val,CC1CCCCC1(N)C(=O)O
502025,NCC1(CC(=O)O)CCCC1,140.10699,[M+H-H2O]+,20.0,val,NCC1(CC(=O)O)CCCC1
502026,NCC1(CC(=O)O)CCCC1,140.10699,[M+H-H2O]+,20.0,val,NCC1(CC(=O)O)CCCC1
502027,NCC1(CC(=O)O)CCCC1,140.10699,[M+H-H2O]+,60.0,val,NCC1(CC(=O)O)CCCC1
502028,NCC1(CC(=O)O)CCCC1,140.10699,[M+H-H2O]+,30.0,val,NCC1(CC(=O)O)CCCC1
502029,NCC1(CC(=O)O)CCCC1,140.10699,[M+H-H2O]+,20.0,val,NCC1(CC(=O)O)CCCC1
502030,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,NCC1(CC(=O)O)CCCC1
502031,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,NCC1(CC(=O)O)CCCC1
502032,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,30.0,val,NCC1(CC(=O)O)CCCC1
502033,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,60.0,val,NCC1(CC(=O)O)CCCC1
502034,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,15.0,val,NCC1(CC(=O)O)CCCC1
502035,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,NCC1(CC(=O)O)CCCC1
502036,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,60.0,val,NCC1(CC(=O)O)CCCC1
502037,NCC1(CC(=O)O)CCCC1,158.11755,[M+H]+,20.0,val,NCC1(CC(=O)O)CCCC1
502038,CN1CCCC1CCC(=O)O,140.10699,[M+H-H2O]+,20.0,val,CN1CCCC1CCC(=O)O
502039,CN1CCCC1CCC(=O)O,140.10699,[M+H-H2O]+,20.0,val,CN1CCCC1CCC(=O)O
502040,CN1CCCC1CCC(=O)O,140.10699,[M+H-H2O]+,60.0,val,CN1CCCC1CCC(=O)O
502041,CN1CCCC1CCC(=O)O,140.10699,[M+H-H2O]+,20.0,val,CN1CCCC1CCC(=O)O
502042,CN1CCCC1CCC(=O)O,140.10699,[M+H-H2O]+,45.0,val,CN1CCCC1CCC(=O)O
502043,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCC1CCC(=O)O
502044,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCC1CCC(=O)O
502045,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,30.0,val,CN1CCCC1CCC(=O)O
502046,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,60.0,val,CN1CCCC1CCC(=O)O
502047,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCC1CCC(=O)O
502048,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,45.0,val,CN1CCCC1CCC(=O)O
502049,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,60.0,val,CN1CCCC1CCC(=O)O
502050,CN1CCCC1CCC(=O)O,158.11755,[M+H]+,20.0,val,CN1CCCC1CCC(=O)O
502051,NCC1CCC(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,NCC1CCC(C(=O)O)CC1
502052,NCC1CCC(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,NCC1CCC(C(=O)O)CC1
502053,NCC1CCC(C(=O)O)CC1,158.11755,[M+H]+,60.0,val,NCC1CCC(C(=O)O)CC1
502054,NCC1CCC(C(=O)O)CC1,158.11755,[M+H]+,30.0,val,NCC1CCC(C(=O)O)CC1
502055,NCC1CCC(C(=O)O)CC1,158.11755,[M+H]+,20.0,val,NCC1CCC(C(=O)O)CC1
502056,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502057,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502058,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,60.0,val,CC(=O)NCCCCCC(=O)O
502059,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,30.0,val,CC(=O)NCCCCCC(=O)O
502060,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502061,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502062,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502063,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,60.0,val,CC(=O)NC(CC(C)C)C(=O)O
502064,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,30.0,val,CC(=O)NC(CC(C)C)C(=O)O
502065,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502066,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,60.0,val,CC(=O)NC(CC(C)C)C(=O)O
502067,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,30.0,val,CC(=O)NC(CC(C)C)C(=O)O
502068,CC(=O)NC(CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502069,CC(=O)N[C@@H](CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)N[C@@H](CC(C)C)C(=O)O
502070,CC(=O)N[C@@H](CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)N[C@@H](CC(C)C)C(=O)O
502071,CC(=O)N[C@@H](CC(C)C)C(=O)O,172.09792,[M-H]-,60.0,val,CC(=O)N[C@@H](CC(C)C)C(=O)O
502072,CC(=O)N[C@@H](CC(C)C)C(=O)O,172.09792,[M-H]-,30.0,val,CC(=O)N[C@@H](CC(C)C)C(=O)O
502073,CC(=O)N[C@@H](CC(C)C)C(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)N[C@@H](CC(C)C)C(=O)O
502074,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502075,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502076,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,60.0,val,CC(=O)NCCCCCC(=O)O
502077,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,15.0,val,CC(=O)NCCCCCC(=O)O
502078,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502079,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502080,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502081,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,60.0,val,CC(=O)NCCCCCC(=O)O
502082,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,15.0,val,CC(=O)NCCCCCC(=O)O
502083,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502084,CC(=O)NC(CC(C)C)C(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502085,CC(=O)NC(CC(C)C)C(=O)O,174.11247,[M+H]+,60.0,val,CC(=O)NC(CC(C)C)C(=O)O
502086,CC(=O)NC(CC(C)C)C(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502087,CC(=O)NC(CC(C)C)C(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NC(CC(C)C)C(=O)O
502088,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502089,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502090,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,60.0,val,CC(=O)NCCCCCC(=O)O
502091,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,30.0,val,CC(=O)NCCCCCC(=O)O
502092,CC(=O)NCCCCCC(=O)O,172.09792,[M-H]-,20.0,val,CC(=O)NCCCCCC(=O)O
502093,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502094,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502095,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,60.0,val,CC(=O)NCCCCCC(=O)O
502096,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,15.0,val,CC(=O)NCCCCCC(=O)O
502097,CC(=O)NCCCCCC(=O)O,174.11247,[M+H]+,20.0,val,CC(=O)NCCCCCC(=O)O
502098,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502099,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,220.08266,[M-H]-,30.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502100,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502101,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502102,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502103,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,256.05934,[M+Cl]-,15.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502104,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502105,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502106,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502107,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,266.08814,[M+FA]-,60.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502108,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,266.08814,[M+FA]-,15.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502109,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502110,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502111,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502112,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,220.08266,[M-H]-,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502113,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502114,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502115,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502116,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,266.08814,[M+FA]-,60.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502117,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,266.08814,[M+FA]-,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502118,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502119,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502120,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502121,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,256.05934,[M+Cl]-,60.0,val,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502122,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,256.05934,[M+Cl]-,15.0,val,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502123,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502124,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,186.07609,[M+H-2H2O]+,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502125,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,186.07609,[M+H-2H2O]+,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502126,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,186.07609,[M+H-2H2O]+,60.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502127,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,186.07609,[M+H-2H2O]+,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502128,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,186.07609,[M+H-2H2O]+,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502129,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502130,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502131,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,204.08665,[M+H-H2O]+,20.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502132,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,204.08665,[M+H-H2O]+,60.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502133,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
502134,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,204.08665,[M+H-H2O]+,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502135,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,204.08665,[M+H-H2O]+,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502136,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,204.08665,[M+H-H2O]+,60.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502137,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502138,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,204.08665,[M+H-H2O]+,20.0,val,CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O
502139,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502140,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502141,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,220.08266,[M-H]-,30.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502142,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,220.08266,[M-H]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502143,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502144,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502145,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,256.05934,[M+Cl]-,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502146,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,256.05934,[M+Cl]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502147,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502148,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502149,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,266.08814,[M+FA]-,60.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502150,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,266.08814,[M+FA]-,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502151,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,266.08814,[M+FA]-,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502152,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502153,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502154,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,204.08665,[M+H-H2O]+,60.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502155,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,204.08665,[M+H-H2O]+,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502156,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,204.08665,[M+H-H2O]+,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502157,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,222.09721,[M+H]+,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502158,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,222.09721,[M+H]+,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502159,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,222.09721,[M+H]+,60.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502160,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,222.09721,[M+H]+,15.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502161,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO,222.09721,[M+H]+,20.0,val,CC(=O)N[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO
502162,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502163,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502164,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,60.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502165,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,30.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502166,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502167,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.10955,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502168,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.10955,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502169,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.10955,[M]+,60.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502170,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.10955,[M]+,30.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502171,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.10955,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502172,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502173,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502174,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,60.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502175,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,30.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502176,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502177,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,30.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502178,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,20.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502179,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO,258.1101,[M]+,60.0,val,C[N+](C)(C)CCOP(=O)(O)OC[C@H](O)CO
502180,O=C(O)c1nsc2c1cccc2Cl,211.95785,[M-H]-,20.0,val,O=C(O)c1nsc2c(Cl)cccc12
502181,O=C(O)c1nsc2c1cccc2Cl,211.95785,[M-H]-,20.0,val,O=C(O)c1nsc2c(Cl)cccc12
502182,O=C(O)c1nsc2c1cccc2Cl,211.95785,[M-H]-,60.0,val,O=C(O)c1nsc2c(Cl)cccc12
502183,O=C(O)c1nsc2c1cccc2Cl,211.95785,[M-H]-,15.0,val,O=C(O)c1nsc2c(Cl)cccc12
502184,O=C(O)c1nsc2c1cccc2Cl,211.95785,[M-H]-,20.0,val,O=C(O)c1nsc2c(Cl)cccc12
502185,O=C(O)c1c(Cl)c2c(nccc2)s1,211.95785,[M-H]-,20.0,val,O=C(O)c1sc2ncccc2c1Cl
502186,O=C(O)c1c(Cl)c2c(nccc2)s1,211.95785,[M-H]-,20.0,val,O=C(O)c1sc2ncccc2c1Cl
502187,O=C(O)c1nc2c(ccc(Cl)c2)s1,211.95785,[M-H]-,20.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502188,O=C(O)c1csc2ncc(Cl)cc12,211.95785,[M-H]-,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502189,O=C(O)c1csc2ncc(Cl)cc12,211.95785,[M-H]-,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502190,O=C(O)c1csc2ncc(Cl)cc12,211.95785,[M-H]-,60.0,val,O=C(O)c1csc2ncc(Cl)cc12
502191,O=C(O)c1csc2ncc(Cl)cc12,211.95785,[M-H]-,15.0,val,O=C(O)c1csc2ncc(Cl)cc12
502192,O=C(O)c1csc2ncc(Cl)cc12,211.95785,[M-H]-,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502193,O=C(O)c1nc2c(ccc(Cl)c2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502194,O=C(O)c1nc2c(ccc(Cl)c2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502195,O=C(O)c1nc2c(ccc(Cl)c2)s1,213.9724,[M+H]+,60.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502196,O=C(O)c1nc2c(ccc(Cl)c2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502197,O=C(O)c1nc2c(ccc(Cl)c2)s1,213.9724,[M+H]+,45.0,val,O=C(O)c1nc2cc(Cl)ccc2s1
502198,O=C(O)c1csc2cc(Cl)cnc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2cc(Cl)cnc12
502199,O=C(O)c1csc2cc(Cl)cnc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2cc(Cl)cnc12
502200,O=C(O)c1csc2cc(Cl)cnc12,213.9724,[M+H]+,60.0,val,O=C(O)c1csc2cc(Cl)cnc12
502201,O=C(O)c1csc2cc(Cl)cnc12,213.9724,[M+H]+,15.0,val,O=C(O)c1csc2cc(Cl)cnc12
502202,O=C(O)c1csc2cc(Cl)cnc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2cc(Cl)cnc12
502203,O=C(O)c1csc2ncc(Cl)cc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502204,O=C(O)c1csc2ncc(Cl)cc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502205,O=C(O)c1csc2ncc(Cl)cc12,213.9724,[M+H]+,60.0,val,O=C(O)c1csc2ncc(Cl)cc12
502206,O=C(O)c1csc2ncc(Cl)cc12,213.9724,[M+H]+,20.0,val,O=C(O)c1csc2ncc(Cl)cc12
502207,O=C(O)c1csc2ncc(Cl)cc12,213.9724,[M+H]+,45.0,val,O=C(O)c1csc2ncc(Cl)cc12
502208,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,20.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502209,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,20.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502210,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,60.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502211,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,20.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502212,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,45.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502213,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,60.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502214,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,20.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502215,O=C(O)c1cc2c(Cl)cncc2s1,213.9724,[M+H]+,45.0,val,O=C(O)c1cc2c(Cl)cncc2s1
502216,O=C(O)c1c(Cl)c2c(nccc2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1sc2ncccc2c1Cl
502217,O=C(O)c1c(Cl)c2c(nccc2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1sc2ncccc2c1Cl
502218,O=C(O)c1c(Cl)c2c(nccc2)s1,213.9724,[M+H]+,60.0,val,O=C(O)c1sc2ncccc2c1Cl
502219,O=C(O)c1c(Cl)c2c(nccc2)s1,213.9724,[M+H]+,20.0,val,O=C(O)c1sc2ncccc2c1Cl
502220,O=C(O)c1c(Cl)c2c(nccc2)s1,213.9724,[M+H]+,45.0,val,O=C(O)c1sc2ncccc2c1Cl
502221,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,20.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502222,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,20.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502223,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,60.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502224,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,15.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502225,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,20.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502226,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,15.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502227,O=C(O)C(F)(F)c1cc(Cl)ccc1,204.98734,[M-H]-,20.0,val,O=C(O)C(F)(F)c1cccc(Cl)c1
502228,O=C(O)c1c(OC(F)F)ccc(Cl)c1,220.98225,[M-H]-,20.0,val,O=C(O)c1cc(Cl)ccc1OC(F)F
502229,O=C(O)c1c(OC(F)F)ccc(Cl)c1,220.98225,[M-H]-,20.0,val,O=C(O)c1cc(Cl)ccc1OC(F)F
502230,O=C(O)c1c(OC(F)F)ccc(Cl)c1,220.98225,[M-H]-,60.0,val,O=C(O)c1cc(Cl)ccc1OC(F)F
502231,O=C(O)c1c(OC(F)F)ccc(Cl)c1,220.98225,[M-H]-,15.0,val,O=C(O)c1cc(Cl)ccc1OC(F)F
502232,O=C(O)c1c(OC(F)F)ccc(Cl)c1,220.98225,[M-H]-,20.0,val,O=C(O)c1cc(Cl)ccc1OC(F)F
502233,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,20.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502234,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,20.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502235,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,60.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502236,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,30.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502237,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,20.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502238,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,60.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502239,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,30.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502240,O=C(O)c1cc(C(F)(F)F)ccc1,189.01689,[M-H]-,20.0,val,O=C(O)c1cccc(C(F)(F)F)c1
502241,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502242,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502243,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502244,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,30.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502245,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502246,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502247,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,30.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502248,O=C(O)c1ccc(C(F)(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)(F)F)cc1
502249,O=C(O)c1ccccc1C(F)(F)F,189.01689,[M-H]-,20.0,val,O=C(O)c1ccccc1C(F)(F)F
502250,O=C(O)c1ccccc1C(F)(F)F,189.01689,[M-H]-,20.0,val,O=C(O)c1ccccc1C(F)(F)F
502251,O=C(O)c1ccccc1C(F)(F)F,189.01689,[M-H]-,60.0,val,O=C(O)c1ccccc1C(F)(F)F
502252,O=C(O)c1ccccc1C(F)(F)F,189.01689,[M-H]-,15.0,val,O=C(O)c1ccccc1C(F)(F)F
502253,O=C(O)c1ccccc1C(F)(F)F,189.01689,[M-H]-,20.0,val,O=C(O)c1ccccc1C(F)(F)F
502254,O=C(O)c1c(F)cc(C(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)F)cc1F
502255,O=C(O)c1c(F)cc(C(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)F)cc1F
502256,O=C(O)c1c(F)cc(C(F)F)cc1,189.01689,[M-H]-,60.0,val,O=C(O)c1ccc(C(F)F)cc1F
502257,O=C(O)c1c(F)cc(C(F)F)cc1,189.01689,[M-H]-,15.0,val,O=C(O)c1ccc(C(F)F)cc1F
502258,O=C(O)c1c(F)cc(C(F)F)cc1,189.01689,[M-H]-,20.0,val,O=C(O)c1ccc(C(F)F)cc1F
502259,O=C(O)Cc1cc(F)c(F)cc1,171.02631,[M-H]-,15.0,val,O=C(O)Cc1ccc(F)c(F)c1
502260,O=C(O)Cc1cc(F)c(F)cc1,171.02631,[M-H]-,15.0,val,O=C(O)Cc1ccc(F)c(F)c1
502261,O=C(O)Cc1cc(F)c(F)cc1,171.02631,[M-H]-,20.0,val,O=C(O)Cc1ccc(F)c(F)c1
502262,O=C(O)Cc1cc(F)c(F)cc1,171.02631,[M-H]-,60.0,val,O=C(O)Cc1ccc(F)c(F)c1
502263,O=C(O)Cc1cc(F)c(F)cc1,171.02631,[M-H]-,15.0,val,O=C(O)Cc1ccc(F)c(F)c1
502264,Cc1csc2ncc(C(=O)O)c(=O)n12,193.00663,[M+H-H2O]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502265,Cc1csc2ncc(C(=O)O)c(=O)n12,193.00663,[M+H-H2O]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502266,Cc1csc2ncc(C(=O)O)c(=O)n12,193.00663,[M+H-H2O]+,60.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502267,Cc1csc2ncc(C(=O)O)c(=O)n12,193.00663,[M+H-H2O]+,30.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502268,Cc1csc2ncc(C(=O)O)c(=O)n12,193.00663,[M+H-H2O]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502269,Cc1csc2ncc(C(=O)O)c(=O)n12,211.01719,[M+H]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502270,Cc1csc2ncc(C(=O)O)c(=O)n12,211.01719,[M+H]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502271,Cc1csc2ncc(C(=O)O)c(=O)n12,211.01719,[M+H]+,60.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502272,Cc1csc2ncc(C(=O)O)c(=O)n12,211.01719,[M+H]+,20.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502273,Cc1csc2ncc(C(=O)O)c(=O)n12,211.01719,[M+H]+,45.0,val,Cc1csc2ncc(C(=O)O)c(=O)n12
502274,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502275,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502276,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,60.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502277,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,15.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502278,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502279,Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(C(Cl)=C(Cl)Cl)c1,377.8949,[M-H]-,20.0,val,Nc1cc(C(Cl)=C(Cl)Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O
502280,Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(C(Cl)=C(Cl)Cl)c1,377.8949,[M-H]-,20.0,val,Nc1cc(C(Cl)=C(Cl)Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O
502281,Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(C(Cl)=C(Cl)Cl)c1,377.8949,[M-H]-,60.0,val,Nc1cc(C(Cl)=C(Cl)Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O
502282,Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(C(Cl)=C(Cl)Cl)c1,377.8949,[M-H]-,15.0,val,Nc1cc(C(Cl)=C(Cl)Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O
502283,Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(C(Cl)=C(Cl)Cl)c1,377.8949,[M-H]-,20.0,val,Nc1cc(C(Cl)=C(Cl)Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O
502284,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502285,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502286,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,60.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502287,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,15.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502288,NS(=O)(=O)c1c(Cl)cc2NC(C(Cl)Cl)NS(=O)(=O)c2c1,377.8949,[M-H]-,20.0,val,NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
502289,CNc1c(C(=O)O)cc(F)cc1,168.04663,[M-H]-,30.0,val,CNc1ccc(F)cc1C(=O)O
502290,CNc1c(C(=O)O)cc(F)cc1,168.04663,[M-H]-,30.0,val,CNc1ccc(F)cc1C(=O)O
502291,CNc1c(C(=O)O)cc(F)cc1,168.04663,[M-H]-,20.0,val,CNc1ccc(F)cc1C(=O)O
502292,CNc1c(C(=O)O)cc(F)cc1,168.04663,[M-H]-,30.0,val,CNc1ccc(F)cc1C(=O)O
502293,O=C(O)CCc1cc(F)cnc1,168.04663,[M-H]-,20.0,val,O=C(O)CCc1cncc(F)c1
502294,O=C(O)CCc1cc(F)cnc1,168.04663,[M-H]-,20.0,val,O=C(O)CCc1cncc(F)c1
502295,O=C(O)CCc1cc(F)cnc1,168.04663,[M-H]-,60.0,val,O=C(O)CCc1cncc(F)c1
502296,O=C(O)CCc1cc(F)cnc1,168.04663,[M-H]-,30.0,val,O=C(O)CCc1cncc(F)c1
502297,O=C(O)CCc1cc(F)cnc1,168.04663,[M-H]-,20.0,val,O=C(O)CCc1cncc(F)c1
502298,O=C(O)CNc1cc(F)ccc1,168.04663,[M-H]-,30.0,val,O=C(O)CNc1cccc(F)c1
502299,O=C(O)CNc1cc(F)ccc1,168.04663,[M-H]-,30.0,val,O=C(O)CNc1cccc(F)c1
502300,O=C(O)CNc1cc(F)ccc1,168.04663,[M-H]-,20.0,val,O=C(O)CNc1cccc(F)c1
502301,O=C(O)CNc1cc(F)ccc1,168.04663,[M-H]-,60.0,val,O=C(O)CNc1cccc(F)c1
502302,O=C(O)CNc1cc(F)ccc1,168.04663,[M-H]-,30.0,val,O=C(O)CNc1cccc(F)c1
502303,CNc1c(F)cc(C(=O)O)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(C(=O)O)cc1F
502304,CNc1c(F)cc(C(=O)O)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(C(=O)O)cc1F
502305,CNc1c(F)cc(C(=O)O)cc1,170.06118,[M+H]+,60.0,val,CNc1ccc(C(=O)O)cc1F
502306,CNc1c(F)cc(C(=O)O)cc1,170.06118,[M+H]+,30.0,val,CNc1ccc(C(=O)O)cc1F
502307,CNc1c(F)cc(C(=O)O)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(C(=O)O)cc1F
502308,CC(C(=O)O)c1c(F)cccn1,170.06118,[M+H]+,20.0,val,CC(C(=O)O)c1ncccc1F
502309,CC(C(=O)O)c1c(F)cccn1,170.06118,[M+H]+,20.0,val,CC(C(=O)O)c1ncccc1F
502310,CC(C(=O)O)c1c(F)cccn1,170.06118,[M+H]+,60.0,val,CC(C(=O)O)c1ncccc1F
502311,CC(C(=O)O)c1c(F)cccn1,170.06118,[M+H]+,30.0,val,CC(C(=O)O)c1ncccc1F
502312,CC(C(=O)O)c1c(F)cccn1,170.06118,[M+H]+,20.0,val,CC(C(=O)O)c1ncccc1F
502313,CNc1c(C(=O)O)cc(F)cc1,134.04006,[M+H-2H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502314,CNc1c(C(=O)O)cc(F)cc1,134.04006,[M+H-2H2O]+,60.0,val,CNc1ccc(F)cc1C(=O)O
502315,CNc1c(C(=O)O)cc(F)cc1,134.04006,[M+H-2H2O]+,30.0,val,CNc1ccc(F)cc1C(=O)O
502316,CNc1c(C(=O)O)cc(F)cc1,134.04006,[M+H-2H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502317,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502318,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502319,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,60.0,val,CNc1ccc(F)cc1C(=O)O
502320,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,30.0,val,CNc1ccc(F)cc1C(=O)O
502321,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502322,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,45.0,val,CNc1ccc(F)cc1C(=O)O
502323,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,60.0,val,CNc1ccc(F)cc1C(=O)O
502324,CNc1c(C(=O)O)cc(F)cc1,152.05062,[M+H-H2O]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502325,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502326,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502327,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,60.0,val,CNc1ccc(F)cc1C(=O)O
502328,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,15.0,val,CNc1ccc(F)cc1C(=O)O
502329,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502330,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,60.0,val,CNc1ccc(F)cc1C(=O)O
502331,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,15.0,val,CNc1ccc(F)cc1C(=O)O
502332,CNc1c(C(=O)O)cc(F)cc1,170.06118,[M+H]+,20.0,val,CNc1ccc(F)cc1C(=O)O
502333,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,20.0,val,O=C(O)CCc1cncc(F)c1
502334,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,20.0,val,O=C(O)CCc1cncc(F)c1
502335,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,60.0,val,O=C(O)CCc1cncc(F)c1
502336,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,20.0,val,O=C(O)CCc1cncc(F)c1
502337,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,45.0,val,O=C(O)CCc1cncc(F)c1
502338,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,60.0,val,O=C(O)CCc1cncc(F)c1
502339,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,20.0,val,O=C(O)CCc1cncc(F)c1
502340,O=C(O)CCc1cc(F)cnc1,170.06118,[M+H]+,45.0,val,O=C(O)CCc1cncc(F)c1
502341,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,343.00688,[M+Cl]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502342,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,343.00688,[M+Cl]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502343,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,343.00688,[M+Cl]-,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502344,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,343.00688,[M+Cl]-,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502345,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502346,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502347,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,353.03568,[M+FA]-,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502348,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,353.03568,[M+FA]-,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502349,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502350,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502351,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502352,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,309.04476,[M+H]+,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502353,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,309.04476,[M+H]+,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502354,Cn1nnnc1Sc1nnc(Sc2nnnn2C)cc1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502355,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,343.00688,[M+Cl]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502356,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,343.00688,[M+Cl]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502357,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,343.00688,[M+Cl]-,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502358,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,343.00688,[M+Cl]-,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502359,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,343.00688,[M+Cl]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502360,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502361,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502362,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502363,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502364,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502365,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502366,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502367,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,353.03568,[M+FA]-,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502368,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502369,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502370,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,309.04476,[M+H]+,60.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502371,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,309.04476,[M+H]+,15.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502372,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1,309.04476,[M+H]+,20.0,val,Cn1nnnc1Sc1ccc(Sc2nnnn2C)nn1
502373,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,20.0,val,O=C(O)c1cc(C2CC2)cs1
502374,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,20.0,val,O=C(O)c1cc(C2CC2)cs1
502375,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,60.0,val,O=C(O)c1cc(C2CC2)cs1
502376,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,20.0,val,O=C(O)c1cc(C2CC2)cs1
502377,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,15.0,val,O=C(O)c1cc(C2CC2)cs1
502378,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,15.0,val,O=C(O)c1cc(C2CC2)cs1
502379,O=C(O)c1cc(C2CC2)cs1,202.9939,[M+Cl]-,20.0,val,O=C(O)c1cc(C2CC2)cs1
502380,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,20.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502381,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,20.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502382,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,60.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502383,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,30.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502384,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,20.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502385,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,60.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502386,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,30.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502387,Cc1c(S(=O)(=O)NC(=O)C2CC2(Cl)Cl)c(N)no1,311.96181,[M-H]-,20.0,val,Cc1onc(N)c1S(=O)(=O)NC(=O)C1CC1(Cl)Cl
502388,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502389,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502390,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,60.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502391,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,15.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502392,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502393,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,60.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502394,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,15.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502395,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502396,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502397,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502398,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,60.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502399,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,15.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502400,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502401,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,60.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502402,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,15.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502403,CC(C)Oc1c(Cl)sc(C(=O)O)c1,218.98882,[M-H]-,20.0,val,CC(C)Oc1cc(C(=O)O)sc1Cl
502404,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,237.04925,[M-H]-,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502405,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,237.04925,[M-H]-,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502406,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,237.04925,[M-H]-,60.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502407,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,237.04925,[M-H]-,15.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502408,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,237.04925,[M-H]-,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502409,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,239.0638,[M+H]+,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502410,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,239.0638,[M+H]+,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502411,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,239.0638,[M+H]+,60.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502412,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,239.0638,[M+H]+,30.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502413,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O,239.0638,[M+H]+,20.0,val,Cc1nn(CCO)c(C(F)(F)F)c1C(=O)O
502414,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21,198.0408,[M-H]-,20.0,val,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
502415,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21,198.0408,[M-H]-,20.0,val,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
502416,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21,198.0408,[M-H]-,60.0,val,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
502417,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21,198.0408,[M-H]-,15.0,val,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
502418,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21,198.0408,[M-H]-,20.0,val,O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
502419,CC(C)(N)c1nc(-c2ccc(Br)o2)no1,272.00291,[M+H]+,20.0,val,CC(C)(N)c1nc(-c2ccc(Br)o2)no1
502420,CC(C)(N)c1nc(-c2ccc(Br)o2)no1,272.00291,[M+H]+,20.0,val,CC(C)(N)c1nc(-c2ccc(Br)o2)no1
502421,CC(C)(N)c1nc(-c2ccc(Br)o2)no1,272.00291,[M+H]+,60.0,val,CC(C)(N)c1nc(-c2ccc(Br)o2)no1
502422,CC(C)(N)c1nc(-c2ccc(Br)o2)no1,272.00291,[M+H]+,15.0,val,CC(C)(N)c1nc(-c2ccc(Br)o2)no1
502423,CC(C)(N)c1nc(-c2ccc(Br)o2)no1,272.00291,[M+H]+,20.0,val,CC(C)(N)c1nc(-c2ccc(Br)o2)no1
502424,CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1,231.00974,[M-H]-,20.0,val,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
502425,CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1,231.00974,[M-H]-,20.0,val,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
502426,CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1,231.00974,[M-H]-,60.0,val,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
502427,CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1,231.00974,[M-H]-,30.0,val,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
502428,CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1,231.00974,[M-H]-,20.0,val,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
502429,Clc1ncc(OC[C@H]2CCN2)cc1,199.06327,[M+H]+,20.0,val,Clc1ccc(OC[C@H]2CCN2)cn1
502430,Clc1ncc(OC[C@H]2CCN2)cc1,199.06327,[M+H]+,20.0,val,Clc1ccc(OC[C@H]2CCN2)cn1
502431,Clc1ncc(OC[C@H]2CCN2)cc1,199.06327,[M+H]+,60.0,val,Clc1ccc(OC[C@H]2CCN2)cn1
502432,Clc1ncc(OC[C@H]2CCN2)cc1,199.06327,[M+H]+,30.0,val,Clc1ccc(OC[C@H]2CCN2)cn1
502433,Clc1ncc(OC[C@H]2CCN2)cc1,199.06327,[M+H]+,20.0,val,Clc1ccc(OC[C@H]2CCN2)cn1
502434,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,20.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502435,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,20.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502436,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,60.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502437,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,30.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502438,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,20.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502439,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,30.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502440,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,20.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502441,CCOC(=O)C(C)(C)c1csc(I)n1,325.97062,[M+H]+,60.0,val,CCOC(=O)C(C)(C)c1csc(I)n1
502442,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,223.08366,[M-H]-,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502443,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,223.08366,[M-H]-,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502444,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,223.08366,[M-H]-,15.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502445,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,223.08366,[M-H]-,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502446,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502447,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502448,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,30.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502449,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,60.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502450,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,15.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502451,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502452,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,60.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502453,O=C(O)c1cn(CC(=O)N2CCCC2)nn1,225.09822,[M+H]+,20.0,val,O=C(O)c1cn(CC(=O)N2CCCC2)nn1
502454,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502455,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502456,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502457,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502458,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502459,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502460,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502461,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502462,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502463,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502464,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502465,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502466,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502467,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,60.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502468,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,30.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502469,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O,225.09822,[M+H]+,20.0,val,Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
502470,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,20.0,val,COc1ccc(CO)c(OC)c1
502471,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,20.0,val,COc1ccc(CO)c(OC)c1
502472,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,60.0,val,COc1ccc(CO)c(OC)c1
502473,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,30.0,val,COc1ccc(CO)c(OC)c1
502474,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,20.0,val,COc1ccc(CO)c(OC)c1
502475,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,60.0,val,COc1ccc(CO)c(OC)c1
502476,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,30.0,val,COc1ccc(CO)c(OC)c1
502477,COc1cc(OC)c(CO)cc1,151.07536,[M+H-H2O]+,20.0,val,COc1ccc(CO)c(OC)c1
502478,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C,231.03327,[M-H]-,20.0,val,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C
502479,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C,231.03327,[M-H]-,20.0,val,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C
502480,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C,231.03327,[M-H]-,60.0,val,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C
502481,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C,231.03327,[M-H]-,30.0,val,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C
502482,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C,231.03327,[M-H]-,20.0,val,Cc1cc(OS(=O)(=O)O)c(C)c(O)c1C
502483,CNC[C@@H]1OCCc2c1scc2,166.0685,[M+H-H2O]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502484,CNC[C@@H]1OCCc2c1scc2,166.0685,[M+H-H2O]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502485,CNC[C@@H]1OCCc2c1scc2,166.0685,[M+H-H2O]+,60.0,val,CNC[C@@H]1OCCc2ccsc21
502486,CNC[C@@H]1OCCc2c1scc2,166.0685,[M+H-H2O]+,30.0,val,CNC[C@@H]1OCCc2ccsc21
502487,CNC[C@@H]1OCCc2c1scc2,166.0685,[M+H-H2O]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502488,CNC[C@@H]1OCCc2c1scc2,184.07906,[M+H]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502489,CNC[C@@H]1OCCc2c1scc2,184.07906,[M+H]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502490,CNC[C@@H]1OCCc2c1scc2,184.07906,[M+H]+,60.0,val,CNC[C@@H]1OCCc2ccsc21
502491,CNC[C@@H]1OCCc2c1scc2,184.07906,[M+H]+,30.0,val,CNC[C@@H]1OCCc2ccsc21
502492,CNC[C@@H]1OCCc2c1scc2,184.07906,[M+H]+,20.0,val,CNC[C@@H]1OCCc2ccsc21
502493,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,20.0,val,Cc1cc([C@@H]2CCCN2C)on1
502494,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,20.0,val,Cc1cc([C@@H]2CCCN2C)on1
502495,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,60.0,val,Cc1cc([C@@H]2CCCN2C)on1
502496,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,30.0,val,Cc1cc([C@@H]2CCCN2C)on1
502497,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,20.0,val,Cc1cc([C@@H]2CCCN2C)on1
502498,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,60.0,val,Cc1cc([C@@H]2CCCN2C)on1
502499,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,30.0,val,Cc1cc([C@@H]2CCCN2C)on1
502500,Cc1noc([C@@H]2CCCN2C)c1,167.11789,[M+H]+,20.0,val,Cc1cc([C@@H]2CCCN2C)on1
502501,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O,225.09931,[M-H]-,20.0,val,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O
502502,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O,225.09931,[M-H]-,20.0,val,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O
502503,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O,225.09931,[M-H]-,60.0,val,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O
502504,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O,225.09931,[M-H]-,30.0,val,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O
502505,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O,225.09931,[M-H]-,20.0,val,NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O
502506,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502507,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502508,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,60.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502509,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,15.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502510,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502511,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502512,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502513,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,60.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502514,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,15.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502515,O=[N+]([O-])c1cncn1CCN1CCOCC1,227.11387,[M+H]+,20.0,val,O=[N+]([O-])c1cncn1CCN1CCOCC1
502516,O=C(O)C1CCC(C2CCCO2)O1,187.09649,[M+H]+,20.0,val,O=C(O)C1CCC(C2CCCO2)O1
502517,O=C(O)C1CCC(C2CCCO2)O1,187.09649,[M+H]+,20.0,val,O=C(O)C1CCC(C2CCCO2)O1
502518,O=C(O)C1CCC(C2CCCO2)O1,187.09649,[M+H]+,60.0,val,O=C(O)C1CCC(C2CCCO2)O1
502519,O=C(O)C1CCC(C2CCCO2)O1,187.09649,[M+H]+,15.0,val,O=C(O)C1CCC(C2CCCO2)O1
502520,O=C(O)C1CCC(C2CCCO2)O1,187.09649,[M+H]+,20.0,val,O=C(O)C1CCC(C2CCCO2)O1
502521,O=C(O)C1CCC(C2CCCO2)O1,209.07843,[M+Na]+,45.0,val,O=C(O)C1CCC(C2CCCO2)O1
502522,O=C(O)C1CCC(C2CCCO2)O1,209.07843,[M+Na]+,45.0,val,O=C(O)C1CCC(C2CCCO2)O1
502523,O=C(O)C1CCC(C2CCCO2)O1,209.07843,[M+Na]+,20.0,val,O=C(O)C1CCC(C2CCCO2)O1
502524,O=C(O)C1CCC(C2CCCO2)O1,209.07843,[M+Na]+,60.0,val,O=C(O)C1CCC(C2CCCO2)O1
502525,O=C(O)C1CCC(C2CCCO2)O1,209.07843,[M+Na]+,45.0,val,O=C(O)C1CCC(C2CCCO2)O1
502526,CC(O)CC1=CC(C(C)O)OC1=O,231.08741,[M+FA]-,20.0,val,CC(O)CC1=CC(C(C)O)OC1=O
502527,CC(O)CC1=CC(C(C)O)OC1=O,231.08741,[M+FA]-,20.0,val,CC(O)CC1=CC(C(C)O)OC1=O
502528,CC(O)CC1=CC(C(C)O)OC1=O,231.08741,[M+FA]-,60.0,val,CC(O)CC1=CC(C(C)O)OC1=O
502529,CC(O)CC1=CC(C(C)O)OC1=O,231.08741,[M+FA]-,15.0,val,CC(O)CC1=CC(C(C)O)OC1=O
502530,CC(O)CC1=CC(C(C)O)OC1=O,231.08741,[M+FA]-,20.0,val,CC(O)CC1=CC(C(C)O)OC1=O
502531,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,276.04821,[M-H]-,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502532,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,276.04821,[M-H]-,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502533,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,276.04821,[M-H]-,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502534,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,276.04821,[M-H]-,30.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502535,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,276.04821,[M-H]-,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502536,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,312.02488,[M+Cl]-,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502537,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,312.02488,[M+Cl]-,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502538,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,312.02488,[M+Cl]-,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502539,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,312.02488,[M+Cl]-,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502540,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,278.06276,[M+H]+,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502541,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,278.06276,[M+H]+,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502542,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,278.06276,[M+H]+,60.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502543,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,278.06276,[M+H]+,15.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502544,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1,278.06276,[M+H]+,20.0,val,NS(=O)(=O)c1cnc(NC2CCCC(O)C2)s1
502545,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,228.09898,[M-H]-,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502546,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,228.09898,[M-H]-,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502547,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,228.09898,[M-H]-,60.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502548,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,228.09898,[M-H]-,30.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502549,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,228.09898,[M-H]-,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502550,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,230.11353,[M+H]+,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502551,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,230.11353,[M+H]+,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502552,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,230.11353,[M+H]+,60.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502553,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,230.11353,[M+H]+,30.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502554,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O,230.11353,[M+H]+,20.0,val,NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O
502555,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,152.107,[M+H-2H2O]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502556,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,152.107,[M+H-2H2O]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502557,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,152.107,[M+H-2H2O]+,60.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502558,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,152.107,[M+H-2H2O]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502559,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,152.107,[M+H-2H2O]+,45.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502560,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502561,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502562,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,15.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502563,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,60.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502564,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,30.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502565,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502566,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,60.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502567,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1,188.12812,[M+H]+,20.0,val,CC(C)(C)O[C@H]1CN[C@H](C(=O)O)C1
502568,CC(C)(C)C(=O)NCCCC(=O)O,186.11357,[M-H]-,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502569,CC(C)(C)C(=O)NCCCC(=O)O,186.11357,[M-H]-,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502570,CC(C)(C)C(=O)NCCCC(=O)O,186.11357,[M-H]-,60.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502571,CC(C)(C)C(=O)NCCCC(=O)O,186.11357,[M-H]-,30.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502572,CC(C)(C)C(=O)NCCCC(=O)O,186.11357,[M-H]-,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502573,CC(C)(C)C(=O)NCCCC(=O)O,188.12812,[M+H]+,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502574,CC(C)(C)C(=O)NCCCC(=O)O,188.12812,[M+H]+,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502575,CC(C)(C)C(=O)NCCCC(=O)O,188.12812,[M+H]+,60.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502576,CC(C)(C)C(=O)NCCCC(=O)O,188.12812,[M+H]+,15.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502577,CC(C)(C)C(=O)NCCCC(=O)O,188.12812,[M+H]+,20.0,val,CC(C)(C)C(=O)NCCCC(=O)O
502578,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1,209.99635,[M-H]-,20.0,val,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1
502579,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1,209.99635,[M-H]-,20.0,val,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1
502580,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1,209.99635,[M-H]-,60.0,val,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1
502581,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1,209.99635,[M-H]-,30.0,val,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1
502582,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1,209.99635,[M-H]-,20.0,val,O=C1Cc2cc(C(=O)O)c(Cl)cc2N1
502583,Cn1ncc2c1c(C(=O)O)c(F)cc2,193.04188,[M-H]-,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502584,Cn1ncc2c1c(C(=O)O)c(F)cc2,193.04188,[M-H]-,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502585,Cn1ncc2c1c(C(=O)O)c(F)cc2,193.04188,[M-H]-,60.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502586,Cn1ncc2c1c(C(=O)O)c(F)cc2,193.04188,[M-H]-,15.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502587,Cn1ncc2c1c(C(=O)O)c(F)cc2,193.04188,[M-H]-,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502588,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502589,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502590,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,60.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502591,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502592,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,45.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502593,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,60.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502594,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,20.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502595,Cn1ncc2c1c(C(=O)O)c(F)cc2,195.05643,[M+H]+,45.0,val,Cn1ncc2ccc(F)c(C(=O)O)c21
502596,Cn1nc(C(=O)O)c2c1ccc(F)c2,177.04587,[M+H-H2O]+,20.0,val,Cn1nc(C(=O)O)c2cc(F)ccc21
502597,Cn1nc(C(=O)O)c2c1ccc(F)c2,177.04587,[M+H-H2O]+,20.0,val,Cn1nc(C(=O)O)c2cc(F)ccc21
502598,Cn1nc(C(=O)O)c2c1ccc(F)c2,177.04587,[M+H-H2O]+,60.0,val,Cn1nc(C(=O)O)c2cc(F)ccc21
502599,Cn1nc(C(=O)O)c2c1ccc(F)c2,177.04587,[M+H-H2O]+,30.0,val,Cn1nc(C(=O)O)c2cc(F)ccc21
502600,Cn1nc(C(=O)O)c2c1ccc(F)c2,177.04587,[M+H-H2O]+,20.0,val,Cn1nc(C(=O)O)c2cc(F)ccc21
502601,O=C(O)c1c(Cl)cc2NCCc2c1,180.02107,[M+H-H2O]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502602,O=C(O)c1c(Cl)cc2NCCc2c1,180.02107,[M+H-H2O]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502603,O=C(O)c1c(Cl)cc2NCCc2c1,180.02107,[M+H-H2O]+,60.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502604,O=C(O)c1c(Cl)cc2NCCc2c1,180.02107,[M+H-H2O]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502605,O=C(O)c1c(Cl)cc2NCCc2c1,180.02107,[M+H-H2O]+,45.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502606,O=C(O)c1c(Cl)cc2NCCc2c1,197.02381,[M]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502607,O=C(O)c1c(Cl)cc2NCCc2c1,197.02381,[M]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502608,O=C(O)c1c(Cl)cc2NCCc2c1,197.02381,[M]+,60.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502609,O=C(O)c1c(Cl)cc2NCCc2c1,197.02381,[M]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502610,O=C(O)c1c(Cl)cc2NCCc2c1,197.02381,[M]+,45.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502611,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502612,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502613,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,60.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502614,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502615,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,45.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502616,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,60.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502617,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502618,O=C(O)c1c(Cl)cc2NCCc2c1,198.03163,[M+H]+,45.0,val,O=C(O)c1cc2c(cc1Cl)NCC2
502619,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502620,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502621,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,60.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502622,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,30.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502623,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502624,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,60.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502625,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,30.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502626,O=C(O)c1ncc(Cl)c(C2CC2)c1,198.03163,[M+H]+,20.0,val,O=C(O)c1cc(C2CC2)c(Cl)cn1
502627,COC(C(=O)O)c1cc(F)cc(F)c1,201.03688,[M-H]-,20.0,val,COC(C(=O)O)c1cc(F)cc(F)c1
502628,COC(C(=O)O)c1cc(F)cc(F)c1,201.03688,[M-H]-,20.0,val,COC(C(=O)O)c1cc(F)cc(F)c1
502629,COC(C(=O)O)c1cc(F)cc(F)c1,201.03688,[M-H]-,15.0,val,COC(C(=O)O)c1cc(F)cc(F)c1
502630,COC(C(=O)O)c1cc(F)cc(F)c1,201.03688,[M-H]-,20.0,val,COC(C(=O)O)c1cc(F)cc(F)c1
502631,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,20.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502632,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,20.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502633,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,60.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502634,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,15.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502635,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,20.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502636,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,60.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502637,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,15.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502638,CC(Oc1cc(F)c(F)cc1)C(=O)O,201.03688,[M-H]-,20.0,val,CC(Oc1ccc(F)c(F)c1)C(=O)O
502639,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,20.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502640,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,20.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502641,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,60.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502642,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,30.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502643,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,20.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502644,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,60.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502645,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,30.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2
502646,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2,249.04925,[M-H]-,20.0,val,O=C(O)Cn1nc(C(F)(F)F)c2c1CCOC2