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

*Links on SpectraBase are not permalinks.
16-Hydroxymethyleneandrost-5-en-3-ol-17-one
SpectraBase Compound ID 1K22uCC3zfu
InChI InChI=1S/C20H28O3/c1-19-7-5-14(22)10-13(19)3-4-15-16(19)6-8-20(2)17(15)9-12(11-21)18(20)23/h3,11,14-17,21-22H,4-10H2,1-2H3/b12-11+
InChIKey LAAMRAVHROVLSR-VAWYXSNFSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 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 96CEhATq0r3
Name 16-Hydroxymethyleneandrost-5-en-3-ol-17-one
Alternate Name(s) 3-Hydroxy-16-(hydroxymethylene)androst-5-en-17-one (16E)-3-hydroxy-16-(hydroxymethylidene)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-19-7-5-14(22)10-13(19)3-4-15-16(19)6-8-20(2)17(15)9-12(11-21)18(20)23/h3,11,14-17,21-22H,4-10H2,1-2H3/b12-11+
InChIKey LAAMRAVHROVLSR-VAWYXSNFSA-N
Molecular Weight 316.441 g/mol
SMILES OC1CC2=CCC3C4C\C(=C/O)C(C4(CCC3C2(CC1)C)C)=O
SPLASH splash10-05ne-4961000000-bdf9686abe0995739195
Wiley ID 1479744