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des-A,B-18-nor-17-hydroxycholestan-8-one
SpectraBase Compound ID Kyxgq0HRTaG
InChI InChI=1S/C17H30O2/c1-12(2)6-4-7-13(3)17(19)11-10-14-15(17)8-5-9-16(14)18/h12-15,19H,4-11H2,1-3H3/t13-,14-,15+,17+/m1/s1
InChIKey AGBVTMUPPGEIFD-AIANPOQGSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4VIXezGnhKw
Name des-A,B-18-nor-17-hydroxycholestan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-12(2)6-4-7-13(3)17(19)11-10-14-15(17)8-5-9-16(14)18/h12-15,19H,4-11H2,1-3H3/t13-,14-,15+,17+/m1/s1
InChIKey AGBVTMUPPGEIFD-AIANPOQGSA-N
Molecular Weight 266.425 g/mol
SMILES O[C@]1([C@@]2([C@@](C(=O)CCC2)([H])CC1)[H])[C@@](CCCC(C)C)(C)[H]
SPLASH splash10-0udr-0920000000-44306a7b1ee4f7e4f3d6
Source of Spectrum E1-39-4503-17
Synonyms (1S,3aR,7aS)-1-hydroxy-1-[(2R)-6-methylheptan-2-yl]-3,3a,5,6,7,7a-hexahydro-2H-inden-4-one (1S,3aR,7aS)-1-[(2R)-6-methylheptan-2-yl]-1-oxidanyl-3,3a,5,6,7,7a-hexahydro-2H-inden-4-one
Wiley ID 1599022