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

*Links on SpectraBase are not permalinks.

Fumaric acid, 2-decyl octyl ester

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

Fumaric acid, 2-decyl octyl ester
SpectraBase Compound ID 8jnrap7HR58
InChI InChI=1S/C22H40O4/c1-4-6-8-10-12-14-16-20(3)26-22(24)18-17-21(23)25-19-15-13-11-9-7-5-2/h17-18,20H,4-16,19H2,1-3H3/b18-17+
InChIKey OSSBBFIPDUQWSO-ISLYRVAYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C22H40O4
Exact Mass 368.29266 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID JhF4O2ioWVZ
Name Fumaric acid, 2-decyl octyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.292659764 u
Formula C22H40O4
InChI InChI=1S/C22H40O4/c1-4-6-8-10-12-14-16-20(3)26-22(24)18-17-21(23)25-19-15-13-11-9-7-5-2/h17-18,20H,4-16,19H2,1-3H3/b18-17+
InChIKey OSSBBFIPDUQWSO-ISLYRVAYSA-N
Molecular Weight 368.558 g/mol
SMILES C(OC(CCCCCCCC)C)(\C=C\C(OCCCCCCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943647