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Fumaric acid, monoamide, N-(4-ethylphenyl)-, octyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, monoamide, N-(4-ethylphenyl)-, octyl ester
SpectraBase Compound ID RwOajMk4mC
InChI InChI=1S/C20H29NO3/c1-3-5-6-7-8-9-16-24-20(23)15-14-19(22)21-18-12-10-17(4-2)11-13-18/h10-15H,3-9,16H2,1-2H3,(H,21,22)/b15-14+
InChIKey MZATZRDOKBNMJO-CCEZHUSRSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6wNdW4pOxtz
Name Fumaric acid, monoamide, N-(4-ethylphenyl)-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 331.214743795 u
Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-3-5-6-7-8-9-16-24-20(23)15-14-19(22)21-18-12-10-17(4-2)11-13-18/h10-15H,3-9,16H2,1-2H3,(H,21,22)/b15-14+
InChIKey MZATZRDOKBNMJO-CCEZHUSRSA-N
Molecular Weight 331.456 g/mol
SMILES C1=C(C=CC(=C1)CC)NC(\C=C\C(OCCCCCCCC)=O)=O