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Fumaric acid, octyl 2-phenylphenyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, octyl 2-phenylphenyl ester
SpectraBase Compound ID GYbDqB41e8d
InChI InChI=1S/C24H28O4/c1-2-3-4-5-6-12-19-27-23(25)17-18-24(26)28-22-16-11-10-15-21(22)20-13-8-7-9-14-20/h7-11,13-18H,2-6,12,19H2,1H3/b18-17+
InChIKey MZIGPERKBNSMSB-ISLYRVAYSA-N
Mol Weight 380.48 g/mol
Molecular Formula C24H28O4
Exact Mass 380.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BinnCgIBgZS
Name Fumaric acid, octyl 2-phenylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 380.198759378 u
Formula C24H28O4
InChI InChI=1S/C24H28O4/c1-2-3-4-5-6-12-19-27-23(25)17-18-24(26)28-22-16-11-10-15-21(22)20-13-8-7-9-14-20/h7-11,13-18H,2-6,12,19H2,1H3/b18-17+
InChIKey MZIGPERKBNSMSB-ISLYRVAYSA-N
Molecular Weight 380.484 g/mol
SMILES CCCCCCCCOC(\C=C\C(OC1=CC=CC=C1C1=CC=CC=C1)=O)=O