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

*Links on SpectraBase are not permalinks.

(3S,5S,8R,9S,10S,13R,14S,17R)-3-but-3-enyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol

Compound with spectra: 2 MS (GC)

(3S,5S,8R,9S,10S,13R,14S,17R)-3-but-3-enyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID 1KLeMObj1O7
InChI InChI=1S/C31H54O/c1-7-8-17-31(32)20-19-29(5)24(21-31)12-13-25-27-15-14-26(23(4)11-9-10-22(2)3)30(27,6)18-16-28(25)29/h7,22-28,32H,1,8-21H2,2-6H3/t23-,24+,25+,26-,27+,28+,29+,30-,31-/m1/s1
InChIKey LHMZCNDKTOGEAZ-CKLDDWCWSA-N
Mol Weight 442.8 g/mol
Molecular Formula C31H54O
Exact Mass 442.417466 g/mol
Enantiomer InChIKey LHMZCNDKTOGEAZ-OZGSWDKASA-N

View Spectrum of (3S,5S,8R,9S,10S,13R,14S,17R)-3-but-3-enyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KC-1992-2921-33

View Spectrum of (3S,5S,8R,9S,10S,13R,14S,17R)-3-but-3-enyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KC-1992-2921-32
3.beta.-Deuteriomethyl-5.alpha.-cholestan-3-.alpha.-ol
3.alpha.-(2'-Hydroxyethyl)-3.beta.-(hydroxymethyl)-5.alpha.-cholestane
3.beta.-(2'-Hydroxyethyl)-3.alpha.-(hydroxymethyl)-5.alpha.-cholestane
(3S)-spiro[ 5.alpha.-Cholestane-3,3'-tetrahydrofuran]
(3R)-spiro[ 5.alpha.-Cholestane-3,3'-tetrahydrofuran]
3'-.epsilon.-Acetoxy-spiro[cholestane-3,1'-cyclobutane]
(3' E)-3'-(Hydroxyimino)spiro[ 5.alpha.-cholestane-3,1'-cycobutane]
(3' Z)-3'-(Acetoxyimino)spiro[ 5.alpha.-cholestane-3,1'-cycobutane]
(3R)-spiro[Cholestane-3,1'-cyclopentan]-3'-one
BQZKZHSNIFFQNY-JFKIADTASA-N
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.