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B-Homo-A-norcholestan-3-one, oxime, (3E,5.alpha.)-
SpectraBase Compound ID 7Y5JEP8EO7M
InChI InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)21-12-13-22-20-10-7-11-24-25(28-29)15-17-27(24,5)23(20)14-16-26(21,22)4/h18-24,29H,6-17H2,1-5H3/b28-25+/t19-,20+,21-,22+,23+,24+,26-,27-/m1/s1
InChIKey KUCOJRNGRSJDLU-KJFVPFBLSA-N
Mol Weight 401.7 g/mol
Molecular Formula C27H47NO
Exact Mass 401.365765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95vx2EsIoFr
Name B-Homo-A-norcholestan-3-one, oxime, (3E,5.alpha.)-
CAS Registry Number 82467-45-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47NO
InChI InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)21-12-13-22-20-10-7-11-24-25(28-29)15-17-27(24,5)23(20)14-16-26(21,22)4/h18-24,29H,6-17H2,1-5H3/b28-25+/t19-,20+,21-,22+,23+,24+,26-,27-/m1/s1
InChIKey KUCOJRNGRSJDLU-KJFVPFBLSA-N
Molecular Weight 401.679 g/mol
SMILES O\N=C\1[C@]2([C@@]([C@]3(CC[C@]4([C@]([C@@]3(CCC2)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CC1)C)[H]
SPLASH splash10-053r-2209200000-5861501f655fd241a4a6
Source of Spectrum KC-1982-936-0
Synonyms (1E,3aR,3bS,5aR,6R,8aS,8bS,11aR)-6-[(1R)-1,5-dimethylhexyl]-3a,5a-dimethylhexadecahydro-1H-indeno[5,4-e]azulen-1-one oxime 1H-indeno[5,4-e]azulene, b-homo-a-norcholestan-3-one deriv. Anti-a-nor-b-homo-5.alpha.-cholestan-3-one oxime
Wiley ID 1370080