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

*Links on SpectraBase are not permalinks.

4,4-Dimethylcholesta-5,7,9(11)-trien-3-ol

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

4,4-Dimethylcholesta-5,7,9(11)-trien-3-ol
SpectraBase Compound ID 6OUPNLrVIfQ
InChI InChI=1S/C29H46O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h11,14-15,19-20,22-23,26,30H,8-10,12-13,16-18H2,1-7H3
InChIKey JSJROSGORQZUFJ-UHFFFAOYSA-N
Mol Weight 410.7 g/mol
Molecular Formula C29H46O
Exact Mass 410.354866 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2omFOMyud92
Name 4,4-Dimethylcholesta-5,7,9(11)-trien-3-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.354866100 u
Formula C29H46O
InChI InChI=1S/C29H46O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h11,14-15,19-20,22-23,26,30H,8-10,12-13,16-18H2,1-7H3
InChIKey JSJROSGORQZUFJ-UHFFFAOYSA-N
Molecular Weight 410.686 g/mol
SMILES C1(CCC2(C(C1(C)C)=CC=C1C2=CCC2(C1CCC2C(CCCC(C)C)C)C)C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.840499