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

*Links on SpectraBase are not permalinks.

Fumaric acid, dec-4-enyl dodecyl ester

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

Fumaric acid, dec-4-enyl dodecyl ester
SpectraBase Compound ID 59yNVvCdQJu
InChI InChI=1S/C26H46O4/c1-3-5-7-9-11-13-14-16-18-20-24-30-26(28)22-21-25(27)29-23-19-17-15-12-10-8-6-4-2/h12,15,21-22H,3-11,13-14,16-20,23-24H2,1-2H3/b15-12+,22-21+
InChIKey OHQMCPOTKCOJQE-APSZPOFBSA-N
Mol Weight 422.7 g/mol
Molecular Formula C26H46O4
Exact Mass 422.33961 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 GFN0cbrAF1R
Name Fumaric acid, dec-4-enyl dodecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.339609957 u
Formula C26H46O4
InChI InChI=1S/C26H46O4/c1-3-5-7-9-11-13-14-16-18-20-24-30-26(28)22-21-25(27)29-23-19-17-15-12-10-8-6-4-2/h12,15,21-22H,3-11,13-14,16-20,23-24H2,1-2H3/b15-12+,22-21+
InChIKey OHQMCPOTKCOJQE-APSZPOFBSA-N
Molecular Weight 422.650 g/mol
SMILES C(OCCC\C=C\CCCCC)(\C=C\C(OCCCCCCCCCCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.980109