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
C11H10ClFN4O4S	train	10
C11H10ClFO3	train	8
C11H10ClN3O4S	train	5
C11H10ClN5O	train	18
C11H10ClNO2	train	10
C11H10ClNO3	train	102
C11H10F2N2O3	train	5
C11H10F2N2O3S	train	10
C11H10F2O2	train	8
C11H10F2O3	train	8
C11H10F3N5O2	train	8
C11H10F3N5S	train	16
C11H10F3NO3S	train	28
C11H10F5N5	train	14
C11H10FN3O4S	train	5
C11H10FNO2	train	10
C11H10FNO3	train	63
C11H10INO3	train	11
C11H10N2	train	6
C11H10N2O2S	train	21
C11H10N2O3	train	266
C11H10N2O3S	train	10
C11H10N2O4	train	5
C11H10N2O4S	train	10
C11H10N4O	train	10
C11H10N4O4	train	5
C11H10N4S3	train	5
C11H10N6O2S2	train	10
C11H10N6OS2	train	13
C11H10N6OS3	train	16
C11H10N8OS	train	10
C11H10O2S	train	10
C11H10O3	train	30
C11H10O3S	train	10
C11H10O4S2	train	8
C11H10O5	train	31
C11H10O5S	train	11
C11H10O6	train	10
C11H10O7	train	8
C11H11BrFN5O	train	9
C11H11BrN2O3S	train	13
C11H11BrN2S	train	8
C11H11BrN4O	train	8
C11H11BrN4O2	train	26
C11H11BrN4O3S	train	5
C11H11BrO3	train	4
C11H11Cl2N	train	10
C11H11Cl2N3O	train	5
C11H11Cl2N3O2S	train	19
C11H11Cl2N5O2	train	23
C11H11ClF4N4O2	train	5
C11H11ClFNO3	train	17
C11H11ClIN3O	train	5
C11H11ClIN5O	train	9
C11H11ClN2O3	train	18
C11H11ClN2O3S	train	5
C11H11ClN2O6S	train	5
C11H11ClO2	train	3
C11H11ClO5	train	5
C11H11ClO6	train	13
C11H11F2N3O2	train	16
C11H11F2NO2	train	21
C11H11F2NO3	train	13
C11H11F2NO4	train	21
C11H11F2NO4S	train	17
C11H11F2NO5	train	10
C11H11F3N2O3S	train	5
C11H11F3N2O5S	train	5
C11H11F3N2S	train	8
C11H11F3N4O	train	8
C11H11F3N4O2	train	8
C11H11F3N4O2S	train	46
C11H11F3N4O3	train	25
C11H11F3N4OS	train	42
C11H11FN2O2	train	10
C11H11FN2O4	train	10
C11H11FN4OS	train	8
C11H11FO3	train	8
C11H11IN2O2	train	34
C11H11IN4O2	train	8
C11H11N3O2	train	189
C11H11N3O2S2	train	16
C11H11N3O3S	train	26
C11H11N3O4S	train	23
C11H11N3O5	train	23
C11H11N3OS	train	16
C11H11N3OS2	train	5
C11H11N5	train	14
C11H11N5O4S	train	5
C11H11NO	train	5
C11H11NO2S	train	13
C11H11NO2S2	train	13
C11H11NO3	train	301
C11H11NO3S	train	15
C11H11NO3S2	train	10
C11H11NO4	train	48
C11H11NO4S	train	16
C11H12BrFN6O2	train	5
C11H12BrN3O2S	train	10
C11H12BrN3OS	train	28

Subsets and Splits

No community queries yet

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