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Fumaric acid, 1-cyclopentylethyl dodecyl ester

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

Fumaric acid, 1-cyclopentylethyl dodecyl ester
SpectraBase Compound ID 1F15hmJ0g9X
InChI InChI=1S/C23H40O4/c1-3-4-5-6-7-8-9-10-11-14-19-26-22(24)17-18-23(25)27-20(2)21-15-12-13-16-21/h17-18,20-21H,3-16,19H2,1-2H3/b18-17+
InChIKey HYXYNEKPVSUBIG-ISLYRVAYSA-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

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SpectraBase Spectrum ID 7WpR3F0ysvk
Name Fumaric acid, 1-cyclopentylethyl dodecyl 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/c1-3-4-5-6-7-8-9-10-11-14-19-26-22(24)17-18-23(25)27-20(2)21-15-12-13-16-21/h17-18,20-21H,3-16,19H2,1-2H3/b18-17+
InChIKey HYXYNEKPVSUBIG-ISLYRVAYSA-N
Molecular Weight 380.569 g/mol
SMILES C(OC(C)C1CCCC1)(\C=C\C(OCCCCCCCCCCCC)=O)=O