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

*Links on SpectraBase are not permalinks.
Des-A,B-25-hydroxy-21-norcholestane-8-one
SpectraBase Compound ID 3CbDCROnauf
InChI InChI=1S/C17H30O2/c1-16(2,19)11-5-4-7-13-9-10-14-15(18)8-6-12-17(13,14)3/h13-14,19H,4-12H2,1-3H3/t13-,14-,17+/m0/s1
InChIKey MTPVTGBJHGIAGH-GRDNDAEWSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 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 C7VtdvA9VE9
Name Des-A,B-25-hydroxy-21-norcholestane-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-16(2,19)11-5-4-7-13-9-10-14-15(18)8-6-12-17(13,14)3/h13-14,19H,4-12H2,1-3H3/t13-,14-,17+/m0/s1
InChIKey MTPVTGBJHGIAGH-GRDNDAEWSA-N
Ionization Type EI
Molecular Weight 266.425 g/mol
Optical Rotation [a]D = -14.0 (c = 1.25, CHCl3)
SMILES OC(CCCC[C@]1(CC[C@]2(C(CCC[C@]12C)=O)[H])[H])(C)C
SPLASH splash10-0gx1-9880000000-a423a6ea5d72e81dd7e9
Source of Spectrum US7648973B2
Wiley ID 1842503