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

*Links on SpectraBase are not permalinks.

Fumaric acid, pentyl tetradec-3-enyl ester

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

Fumaric acid, pentyl tetradec-3-enyl ester
SpectraBase Compound ID G3N9XB2QPx6
InChI InChI=1S/C23H40O4/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-27-23(25)19-18-22(24)26-20-16-6-4-2/h14-15,18-19H,3-13,16-17,20-21H2,1-2H3/b15-14+,19-18+
InChIKey IFTCZBCCLDZSPW-HOTZHUKSSA-N
Mol Weight 380.6 g/mol
Molecular Formula C23H40O4
Exact Mass 380.29266 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 Kf73y2j01ev
Name Fumaric acid, pentyl tetradec-3-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.292659764 u
Formula C23H40O4
InChI InChI=1S/C23H40O4/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-27-23(25)19-18-22(24)26-20-16-6-4-2/h14-15,18-19H,3-13,16-17,20-21H2,1-2H3/b15-14+,19-18+
InChIKey IFTCZBCCLDZSPW-HOTZHUKSSA-N
Molecular Weight 380.569 g/mol
SMILES C(\C=C\C(OCCCCC)=O)(OCC\C=C\CCCCCCCCCC)=O