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
C27H20N2O10	train	26
C27H20N4O2	train	36
C27H21ClFN3O2	train	15
C27H21ClN2O2	train	11
C27H21FN2O3S	train	18
C27H21FN4O	train	19
C27H21N3O4S	train	8
C27H21N5	train	24
C27H21NO5	train	7
C27H22BrNO4S	train	10
C27H22Cl2N4	train	10
C27H22Cl2N4O	train	13
C27H22ClN3O4	train	12
C27H22F4N4O3	train	5
C27H22FNO5	train	8
C27H22N2O10S4	train	7
C27H22N2O2S	train	8
C27H22N2O3	train	4
C27H22N2O4	train	18
C27H22N4O3S	train	8
C27H22O12	train	25
C27H22O18	train	10
C27H23ClN2O5	train	8
C27H23F2N3O7S	train	13
C27H23F2N7O3	train	21
C27H23F6NO6S	train	13
C27H23FN4O4S	train	5
C27H23N3O3	train	8
C27H23N3O4	train	15
C27H23N3O4S	train	21
C27H23N5O3	train	10
C27H23N5O3S	train	8
C27H23N5O4	train	58
C27H23N5OS	train	5
C27H23N7O	train	8
C27H24F2N6O4	train	7
C27H24F3N5O2	train	15
C27H24FN7O3	train	32
C27H24N2O6	train	13
C27H24N4O2S	train	18
C27H24N4O3	train	8
C27H24N4O5	train	5
C27H24N6	train	5
C27H24O18	train	38
C27H25BrN2O5S	train	14
C27H25ClF3N3O2	train	51
C27H25ClN4O2	train	18
C27H25F2N3OS	train	8
C27H25F3N8O2	train	19
C27H25F3N8OS	train	23
C27H25FN2O3	train	8
C27H25FN4O4S	train	9
C27H25N3O2	train	29
C27H25N3O3	train	19
C27H25N3O5	train	8
C27H25N5O	train	8
C27H25N5O2	train	54
C27H25N5O3	train	9
C27H25NO5	train	21
C27H25NO6	train	10
C27H26BrF2N3O2	train	13
C27H26BrN3O6S	train	5
C27H26ClF3N6O3	train	26
C27H26ClN3O2	train	8
C27H26ClN3O7S2	train	16
C27H26F5N7O3	train	18
C27H26N2O3	train	8
C27H26N2O4S	train	2
C27H26N2O6	train	43
C27H26N2O7	train	16
C27H26N4O2S	train	8
C27H26N4O4S	train	21
C27H26N4O5S	train	16
C27H26N6O2	train	18
C27H26N6O3	train	51
C27H26O12	train	15
C27H26O18	train	16
C27H27BrN2O	train	14
C27H27Cl2FN8	train	13
C27H27Cl2N5O3S	train	8
C27H27F2N3O3	train	21
C27H27F2N5O3	train	21
C27H27F2N7O5S2	train	14
C27H27F3N2O4	train	16
C27H27F3N2O4S	train	19
C27H27FN4O	train	13
C27H27FN8O3	train	16
C27H27N3O	train	7
C27H27N3O2	train	8
C27H27N3O3	train	8
C27H27N3O4S	train	5
C27H27N5	train	8
C27H27N5O2	train	10
C27H27N5O2S	train	5
C27H27N5O3	train	24
C27H27NO5	train	29
C27H27NO6	train	26
C27H27NO7	train	13
C27H28Br2O5S	train	10
C27H28ClFN6O	train	25

Subsets and Splits

No community queries yet

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