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

*Links on SpectraBase are not permalinks.
6-ALPHA-HYDROXYANDROSTA-1,4-DIENE-3,17-DIONE
SpectraBase Compound ID HSrlV8kDd5
InChI InChI=1S/C19H24O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h5,7,9,12-14,16,21H,3-4,6,8,10H2,1-2H3/t12-,13-,14-,16-,18+,19-/m0/s1
InChIKey JCJRNURQXRSFJI-BMSLSITRSA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 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 3v5EOLxsmG
Name (6S,8R,9S,10R,13S,14S)-10,13-dimethyl-6-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h5,7,9,12-14,16,21H,3-4,6,8,10H2,1-2H3/t12-,13-,14-,16-,18+,19-/m0/s1
InChIKey JCJRNURQXRSFJI-BMSLSITRSA-N
Molecular Weight 300.398 g/mol
SMILES O[C@@]1(C2=CC(C=C[C@@]2([C@@]2([C@@](C1)([C@@]1(CCC([C@@]1(C)CC2)=O)[H])[H])[H])C)=O)[H]
SPLASH splash10-0a6u-9400000000-af94b3b66ca6749424e0
Source of Spectrum G4-63-640-1
Synonyms (6S,8R,9S,10R,13S,14S)-6-hydroxy-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione (6S,8R,9S,10R,13S,14S)-6-hydroxy-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-quinone
Wiley ID 1608388