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Fumaric acid, 2-phenylethyl undecyl ester

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

Fumaric acid, 2-phenylethyl undecyl ester
SpectraBase Compound ID 5jxq4rKdkM7
InChI InChI=1S/C23H34O4/c1-2-3-4-5-6-7-8-9-13-19-26-22(24)16-17-23(25)27-20-18-21-14-11-10-12-15-21/h10-12,14-17H,2-9,13,18-20H2,1H3/b17-16+
InChIKey GBLOBAYOPBQHIH-WUKNDPDISA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QfMZI1dKAa
Name Fumaric acid, 2-phenylethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 374.245709571 u
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-2-3-4-5-6-7-8-9-13-19-26-22(24)16-17-23(25)27-20-18-21-14-11-10-12-15-21/h10-12,14-17H,2-9,13,18-20H2,1H3/b17-16+
InChIKey GBLOBAYOPBQHIH-WUKNDPDISA-N
Molecular Weight 374.521 g/mol
SMILES C(COC(\C=C\C(OCCC1=CC=CC=C1)=O)=O)CCCCCCCCC