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Fumaric acid, 4-(2-phenylpropyl-2)phenyl propyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 4-(2-phenylpropyl-2)phenyl propyl ester
SpectraBase Compound ID 6KIBz7Clb3K
InChI InChI=1S/C22H24O4/c1-4-16-25-20(23)14-15-21(24)26-19-12-10-18(11-13-19)22(2,3)17-8-6-5-7-9-17/h5-15H,4,16H2,1-3H3/b15-14+
InChIKey COHWTEFWIZGNFY-CCEZHUSRSA-N
Mol Weight 352.43 g/mol
Molecular Formula C22H24O4
Exact Mass 352.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YuBLFVMWsl
Name Fumaric acid, 4-(2-phenylpropyl-2)phenyl propyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.167459249 u
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-4-16-25-20(23)14-15-21(24)26-19-12-10-18(11-13-19)22(2,3)17-8-6-5-7-9-17/h5-15H,4,16H2,1-3H3/b15-14+
InChIKey COHWTEFWIZGNFY-CCEZHUSRSA-N
Molecular Weight 352.430 g/mol
SMILES C(\C=C\C(OCCC)=O)(OC1=CC=C(C=C1)C(C1=CC=CC=C1)(C)C)=O