For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5.ALPHA.-ANDROSTAN-16.ALPHA.-OL-17-ONE
SpectraBase Compound ID DYk99SkiBjI
InChI InChI=1S/C19H30O2/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/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,18+,19+/m1/s1
InChIKey BHZXMBDTBMXJAX-ZLOBMTTQSA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HlK07lyVO2K
Name 5.ALPHA.-ANDROSTAN-16.ALPHA.-OL-17-ONE
CAS Registry Number 25846-17-7
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 290.224580204 u
Formula C19H30O2
InChI InChI=1S/C19H30O2/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/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,18+,19+/m1/s1
InChIKey BHZXMBDTBMXJAX-ZLOBMTTQSA-N
Molecular Weight 290.447 g/mol
Nominal Mass 290 u
Number of Peaks 72
SMILES O[C@@]1(C[C@]2([C@@]3(CC[C@]4(CCCC[C@@]4([C@]3(CC[C@@]2(C1=O)C)[H])C)[H])[H])[H])[H]
SPLASH splash10-014i-6590000000-b861060d08ce284b00d4
Source File Reference LMCM-72976-682P
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 16-HYDROXYANDROSTAN-17-ONE (5R,8R,9S,10S,13S,14S,16R)-16-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
Wiley ID 4_1127