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

*Links on SpectraBase are not permalinks.
17-Methyl-13,17-seco-androst-4-en-3,17-dione
SpectraBase Compound ID D7vBYAmKfj3
InChI InChI=1S/C20H30O2/c1-13-4-9-19-18(17(13)7-5-14(2)21)8-6-15-12-16(22)10-11-20(15,19)3/h12-13,17-19H,4-11H2,1-3H3/t13-,17-,18+,19+,20+/m1/s1
InChIKey MTCRXLMHPCUKFO-XEQWONBNSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 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 DleksfqWMfu
Name 17-Methyl-13,17-seco-androst-4-en-3,17-dione
Alternate Name(s) (4aR,4bS,7R,8R,8aS)-4a,7-dimethyl-8-(3-oxobutyl)-4,4a,4b,5,6,7,8,8a,9,10-decahydrophenanthren-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-13-4-9-19-18(17(13)7-5-14(2)21)8-6-15-12-16(22)10-11-20(15,19)3/h12-13,17-19H,4-11H2,1-3H3/t13-,17-,18+,19+,20+/m1/s1
InChIKey MTCRXLMHPCUKFO-XEQWONBNSA-N
Literature Reference DOI 10.1002/ardp.19893220311
Molecular Weight 302.458 g/mol
SMILES C1(CC[C@@]2([C@]3(CC[C@]([C@]([C@@]3(CCC2=C1)[H])(CCC(=O)C)[H])(C)[H])[H])C)=O
SPLASH splash10-0fk9-0963000000-905a3ad23eb84d9c605f
Source of Spectrum APC-322-175-5
Wiley ID 1788570