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

*Links on SpectraBase are not permalinks.

Fumaric acid, 2,4-dimethylpent-3-yl tridecyl ester

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

Fumaric acid, 2,4-dimethylpent-3-yl tridecyl ester
SpectraBase Compound ID HRvgwlh1eej
InChI InChI=1S/C24H44O4/c1-6-7-8-9-10-11-12-13-14-15-16-19-27-22(25)17-18-23(26)28-24(20(2)3)21(4)5/h17-18,20-21,24H,6-16,19H2,1-5H3/b18-17+
InChIKey BLSQXBNOSWJHOM-ISLYRVAYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C24H44O4
Exact Mass 396.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 24v5h7OpfiL
Name Fumaric acid, 2,4-dimethylpent-3-yl tridecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.323959893 u
Formula C24H44O4
InChI InChI=1S/C24H44O4/c1-6-7-8-9-10-11-12-13-14-15-16-19-27-22(25)17-18-23(26)28-24(20(2)3)21(4)5/h17-18,20-21,24H,6-16,19H2,1-5H3/b18-17+
InChIKey BLSQXBNOSWJHOM-ISLYRVAYSA-N
Molecular Weight 396.612 g/mol
SMILES C(OC(C(C)C)C(C)C)(\C=C\C(OCCCCCCCCCCCCC)=O)=O