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Fumaric acid, decyl 2-isopropoxyphenyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, decyl 2-isopropoxyphenyl ester
SpectraBase Compound ID 366w5JsYUoK
InChI InChI=1S/C23H34O5/c1-4-5-6-7-8-9-10-13-18-26-22(24)16-17-23(25)28-21-15-12-11-14-20(21)27-19(2)3/h11-12,14-17,19H,4-10,13,18H2,1-3H3/b17-16+
InChIKey QWKCGAZNPJYXMG-WUKNDPDISA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5aEqc1O6DBX
Name Fumaric acid, decyl 2-isopropoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 390.240624190 u
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-4-5-6-7-8-9-10-13-18-26-22(24)16-17-23(25)28-21-15-12-11-14-20(21)27-19(2)3/h11-12,14-17,19H,4-10,13,18H2,1-3H3/b17-16+
InChIKey QWKCGAZNPJYXMG-WUKNDPDISA-N
Molecular Weight 390.520 g/mol
SMILES CCCCCCCCCCOC(\C=C\C(OC1=C(C=CC=C1)OC(C)C)=O)=O