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Benzenesulfonic acid, 4-methyl-, [(5.alpha.)-androstan-7-ylidene]hydrazide
SpectraBase Compound ID 63y9ELaMYVe
InChI InChI=1S/C26H38N2O2S/c1-18-9-11-20(12-10-18)31(29,30)28-27-23-17-19-7-4-5-15-26(19,3)22-13-16-25(2)14-6-8-21(25)24(22)23/h9-12,19,21-22,24,28H,4-8,13-17H2,1-3H3/b27-23+/t19-,21+,22+,24+,25+,26+/m1/s1
InChIKey PWDFVPNYMOQKST-AXZVPICBSA-N
Mol Weight 442.7 g/mol
Molecular Formula C26H38N2O2S
Exact Mass 442.2654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9870d6Ll4A
Name Benzenesulfonic acid, 4-methyl-, [(5.alpha.)-androstan-7-ylidene]hydrazide
CAS Registry Number 84600-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38N2O2S
InChI InChI=1S/C26H38N2O2S/c1-18-9-11-20(12-10-18)31(29,30)28-27-23-17-19-7-4-5-15-26(19,3)22-13-16-25(2)14-6-8-21(25)24(22)23/h9-12,19,21-22,24,28H,4-8,13-17H2,1-3H3/b27-23+/t19-,21+,22+,24+,25+,26+/m1/s1
InChIKey PWDFVPNYMOQKST-AXZVPICBSA-N
Molecular Weight 442.662 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)\N=C\1[C@@]2([C@@](CC[C@]3([C@]2(CCC3)[H])C)([H])[C@@]2([C@@](C1)(CCCC2)[H])C)[H]
SPLASH splash10-0007-8970000000-1e6d7bca140a2927a12a
Source of Spectrum B-35-2127-0
Synonyms 5.alpha.-androstan-7-one tosylhydrazone Androstane, benzenesulfonic acid deriv. N'-[(5alpha)-androstan-7-ylidene]-4-methylbenzenesulfonohydrazide
Wiley ID 1385415