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

*Links on SpectraBase are not permalinks.
Androstan-17-one, 3-[(dimethylphosphinyl)oxy]-, (3.alpha.,5.alpha.)-
SpectraBase Compound ID GnVIaKFx9Xd
InChI InChI=1S/C21H35O3P/c1-20-11-9-15(24-25(3,4)23)13-14(20)5-6-16-17-7-8-19(22)21(17,2)12-10-18(16)20/h14-18H,5-13H2,1-4H3/t14-,15+,16-,17-,18-,20-,21-/m0/s1
InChIKey FTDACYDQDYCQFP-XVYLQWLCSA-N
Mol Weight 366.5 g/mol
Molecular Formula C21H35O3P
Exact Mass 366.232382 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 TmDQZn3Ay7
Name Androstan-17-one, 3-[(dimethylphosphinyl)oxy]-, (3.alpha.,5.alpha.)-
CAS Registry Number 56871-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H35O3P
InChI InChI=1S/C21H35O3P/c1-20-11-9-15(24-25(3,4)23)13-14(20)5-6-16-17-7-8-19(22)21(17,2)12-10-18(16)20/h14-18H,5-13H2,1-4H3/t14-,15+,16-,17-,18-,20-,21-/m0/s1
InChIKey FTDACYDQDYCQFP-XVYLQWLCSA-N
Molecular Weight 366.482 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CC[C@]2(C[C@](OP(=O)(C)C)(CC1)[H])[H])[H])C
SPLASH splash10-0002-9010000000-54e46f3772a0d33fb9bf
Source of Spectrum KO-3-67-3
Synonyms (3alpha,5alpha)-17-oxoandrostan-3-yl dimethylphosphinate Dimethyl phosphinic ester of 3.alpha.-etiocholanolone
Wiley ID 1352091