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

*Links on SpectraBase are not permalinks.
Pregna-5,17(20)-dien-3-ol, (3.beta.,17E)-
SpectraBase Compound ID Ap1LKFmRE8H
InChI InChI=1S/C21H32O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h4-5,16-19,22H,6-13H2,1-3H3/b14-4+
InChIKey PCCYSJPJAOIFIV-LNKIKWGQSA-N
Mol Weight 300.5 g/mol
Molecular Formula C21H32O
Exact Mass 300.245316 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 9IkWd4IaDN1
Name Pregna-5,17(20)-dien-3-ol, (3.beta.,17E)-
Alternate Name(s) (17E)-Pregna-5,17-dien-3-ol (17E)-17-ethylidene-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-ol Pregna-5,17(20)-dien-3.beta.-ol, (E)-
CAS Registry Number 1159-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O
InChI InChI=1S/C21H32O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h4-5,16-19,22H,6-13H2,1-3H3/b14-4+
InChIKey PCCYSJPJAOIFIV-LNKIKWGQSA-N
Molecular Weight 300.486 g/mol
SMILES OC1CC2=CCC3C4CC\C(=C/C)C4(CCC3C2(CC1)C)C
SPLASH splash10-05mo-5920000000-7ffb4fbc490e8878462b
Source of Spectrum SD-1981-0-0
Wiley ID 44630