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17β-hydroxy-5α-androst-1-en-3-one
SpectraBase Compound ID JjTsx99C4VD
InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1
InChIKey OKJCFMUGMSVJBG-ABEVXSGRSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLCX6GXg52o
Name 5.ALPHA.-ANDROST-1-ENE-17.BETA.-OL-3-ONE
CAS Registry Number 65-06-5
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 288.208930140 u
Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1
InChIKey OKJCFMUGMSVJBG-ABEVXSGRSA-N
Molecular Weight 288.431 g/mol
Nominal Mass 288 u
Number of Peaks 108
SMILES O[C@]1(CC[C@]2([C@@]3(CC[C@]4(CC(C=C[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])[H])[H]
SPLASH splash10-054w-9870000000-a6373d829c2a06fb4895
Source File Reference LMCM-61118-586X
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 17-HYDROXYANDROST-1-EN-3-ONE (5S,8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one
Wiley ID 4_1009