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5.ALPHA.-ANDROSTANE-16.BETA.,17.ALPHA.-DIOL
SpectraBase Compound ID 2sqGXxctwHv
InChI InChI=1S/C19H32O2/c1-18-9-4-3-5-12(18)6-7-13-14(18)8-10-19(2)15(13)11-16(20)17(19)21/h12-17,20-21H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18+,19+/m1/s1
InChIKey YSIYIHBXKQHUCK-ULTMTAQRSA-N
Mol Weight 292.5 g/mol
Molecular Formula C19H32O2
Exact Mass 292.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ih47xz683oa
Name 5.ALPHA.-ANDROSTANE-16.BETA.,17.ALPHA.-DIOL
CAS Registry Number 32694-31-8
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 292.240230268 u
Formula C19H32O2
InChI InChI=1S/C19H32O2/c1-18-9-4-3-5-12(18)6-7-13-14(18)8-10-19(2)15(13)11-16(20)17(19)21/h12-17,20-21H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18+,19+/m1/s1
InChIKey YSIYIHBXKQHUCK-ULTMTAQRSA-N
Molecular Weight 292.463 g/mol
Nominal Mass 292 u
Number of Peaks 130
SMILES O[C@@]1([C@]([C@]2(CC[C@@]3([C@]4(CCCC[C@@]4(CC[C@]3([C@@]2(C1)[H])[H])[H])C)[H])C)(O)[H])[H]
SPLASH splash10-014i-9760000000-76a9e22ea5f5d4234136
Source File Reference LMCM-51622-258M
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROSTANE-16,17-DIOL (5R,8R,9S,10S,13S,14S,16S,17S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-16,17-diol
Wiley ID 4_2169