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

*Links on SpectraBase are not permalinks.

Fumaric acid, dodecyl tetradec-3-enyl ester

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

Fumaric acid, dodecyl tetradec-3-enyl ester
SpectraBase Compound ID 2Y1M6txLj7B
InChI InChI=1S/C30H54O4/c1-3-5-7-9-11-13-15-16-18-20-22-24-28-34-30(32)26-25-29(31)33-27-23-21-19-17-14-12-10-8-6-4-2/h20,22,25-26H,3-19,21,23-24,27-28H2,1-2H3/b22-20+,26-25+
InChIKey YQDQWBFXNCSFPC-BMRAXTPNSA-N
Mol Weight 478.8 g/mol
Molecular Formula C30H54O4
Exact Mass 478.40221 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 81GSxSxDull
Name Fumaric acid, dodecyl tetradec-3-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.402210215 u
Formula C30H54O4
InChI InChI=1S/C30H54O4/c1-3-5-7-9-11-13-15-16-18-20-22-24-28-34-30(32)26-25-29(31)33-27-23-21-19-17-14-12-10-8-6-4-2/h20,22,25-26H,3-19,21,23-24,27-28H2,1-2H3/b22-20+,26-25+
InChIKey YQDQWBFXNCSFPC-BMRAXTPNSA-N
Molecular Weight 478.758 g/mol
SMILES C(\C=C\C(OCCCCCCCCCCCC)=O)(OCC\C=C\CCCCCCCCCC)=O