Subset (17)

split_A_formula_split · 21.1k rows

Split (1)

train · 21.1k rows

formula stringlengths 5 17	fold stringclasses 3 values	n_spectra int64 1 627
C17H19F3N2O5S2	train	5
C17H19F3N4	train	8
C17H19F3N4O	train	40
C17H19F3N4O2	train	21
C17H19F3N4O3	train	65
C17H19F3N6	train	8
C17H19F3N6O	train	32
C17H19F3N6O2	train	44
C17H19FN2	train	5
C17H19FN2O2	train	52
C17H19FN2O3	train	61
C17H19FN2O4S	train	42
C17H19FN2OS	train	21
C17H19FN2S	train	25
C17H19FN4O	train	56
C17H19FN4O2	train	36
C17H19FN4O2S	train	15
C17H19FN4O3	train	52
C17H19FN4O4	train	31
C17H19FN4O4S	train	13
C17H19FN4O5S	train	10
C17H19FN4OS	train	13
C17H19FN6O	train	16
C17H19IN4O3S	train	8
C17H19N2O+	train	6
C17H19N3	train	37
C17H19N3O	train	102
C17H19N3O2	train	121
C17H19N3O3	train	498
C17H19N3O3S	train	365
C17H19N3O4	train	247
C17H19N3O4S	train	18
C17H19N3O5	train	51
C17H19N3O6S2	train	5
C17H19N3OS	train	103
C17H19N3OS2	train	34
C17H19N5	train	40
C17H19N5O	train	374
C17H19N5O2	train	418
C17H19N5O2S	train	10
C17H19N5O4	train	10
C17H19N5O5	train	15
C17H19N5OS	train	140
C17H19N5OS2	train	8
C17H19N5S	train	43
C17H19N7	train	24
C17H19N7O	train	60
C17H19N7O3	train	19
C17H19N7O5S3	train	13
C17H19N9	train	8
C17H19NO2S	train	59
C17H19NO2S2	train	5
C17H19NO3	train	51
C17H19NO3S	train	72
C17H19NO4S	train	49
C17H19NO4S3	train	5
C17H19NO5S	train	54
C17H19NO6	train	31
C17H19NO6S	train	10
C17H19NO8S	train	31
C17H20BNO5	train	10
C17H20BrN3O2	train	8
C17H20BrN3O3	train	16
C17H20BrN3O3S2	train	18
C17H20BrN5O2	train	18
C17H20Cl2N6S	train	5
C17H20ClF2NO3	train	8
C17H20ClF4N7O	train	5
C17H20ClFN2O	train	8
C17H20ClFN4O2	train	8
C17H20ClN3	train	7
C17H20ClN3O2	train	111
C17H20ClN3O2S	train	62
C17H20ClN3O3	train	100
C17H20ClN3O3S3	train	10
C17H20ClN3OS	train	21
C17H20ClN5O	train	65
C17H20ClN5O2	train	5
C17H20ClN5O3	train	5
C17H20ClNO2	train	8
C17H20ClNO3	train	16
C17H20ClNO4	train	22
C17H20ClNOS	train	5
C17H20F2N2O	train	23
C17H20F2N2O2	train	29
C17H20F2N2O3	train	51
C17H20F2N4O	train	39
C17H20F2N4O2	train	24
C17H20F2N4O3	train	17
C17H20F2N4O3S	train	25
C17H20F2N6S	train	5
C17H20F3N3O3	train	12
C17H20F3N3O3S	train	10
C17H20F3N5O	train	28
C17H20F3N5O3S	train	14
C17H20F3N5OS	train	8
C17H20F3N7O2	train	8
C17H20F3NO3	train	16
C17H20F3NO3S	train	8
C17H20F3NO5	train	8

Subsets and Splits

No community queries yet

The top public SQL queries from the community will appear here once available.