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Fumaric acid, 2-phenylphenyl undecyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 2-phenylphenyl undecyl ester
SpectraBase Compound ID Zh6pyxbwaF
InChI InChI=1S/C27H34O4/c1-2-3-4-5-6-7-8-9-15-22-30-26(28)20-21-27(29)31-25-19-14-13-18-24(25)23-16-11-10-12-17-23/h10-14,16-21H,2-9,15,22H2,1H3/b21-20+
InChIKey QAVVPDIENASAHF-QZQOTICOSA-N
Mol Weight 422.6 g/mol
Molecular Formula C27H34O4
Exact Mass 422.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BmLDIZJnmhI
Name Fumaric acid, 2-phenylphenyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 422.245709571 u
Formula C27H34O4
InChI InChI=1S/C27H34O4/c1-2-3-4-5-6-7-8-9-15-22-30-26(28)20-21-27(29)31-25-19-14-13-18-24(25)23-16-11-10-12-17-23/h10-14,16-21H,2-9,15,22H2,1H3/b21-20+
InChIKey QAVVPDIENASAHF-QZQOTICOSA-N
Molecular Weight 422.565 g/mol
SMILES C(\C=C\C(OC1=CC=CC=C1C1=CC=CC=C1)=O)(OCCCCCCCCCCC)=O