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

*Links on SpectraBase are not permalinks.

Glycerol, 1-o-cis-vaccenyl

View entire compound with spectra: 1 NMR, and 1 FTIR

Glycerol, 1-o-cis-vaccenyl
SpectraBase Compound ID 9WhVQSBKtb5
InChI InChI=1S/C21H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22/h7-8,21-23H,2-6,9-20H2,1H3/b8-7-
InChIKey VPYHUTCCGRNLPL-FPLPWBNLSA-N
Mol Weight 342.6 g/mol
Molecular Formula C21H42O3
Exact Mass 342.313395 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 UGDp1ICZyJ
Name Glycerol, 1-o-cis-vaccenyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.313395209 u
Formula C21H42O3
InChI InChI=1S/C21H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22/h7-8,21-23H,2-6,9-20H2,1H3/b8-7-
InChIKey VPYHUTCCGRNLPL-FPLPWBNLSA-N
Molecular Weight 342.564 g/mol
SMILES C(OCCCCCCCCCC\C=C/CCCCCC)C(O)CO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947351