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Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-2-methylphenyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-2-methylphenyl ester
SpectraBase Compound ID 47rJeUCM1e5
InChI InChI=1S/C18H16ClNO3/c1-13-12-14(19)8-9-16(13)23-18(22)11-10-17(21)20(2)15-6-4-3-5-7-15/h3-12H,1-2H3/b11-10+
InChIKey SNROMINFIHECEK-ZHACJKMWSA-N
Mol Weight 329.78 g/mol
Molecular Formula C18H16ClNO3
Exact Mass 329.081871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fm6bx65r8vg
Name Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-2-methylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.081871076 u
Formula C18H16ClNO3
InChI InChI=1S/C18H16ClNO3/c1-13-12-14(19)8-9-16(13)23-18(22)11-10-17(21)20(2)15-6-4-3-5-7-15/h3-12H,1-2H3/b11-10+
InChIKey SNROMINFIHECEK-ZHACJKMWSA-N
Molecular Weight 329.783 g/mol
SMILES CC1=C(C=CC(=C1)Cl)OC(=O)\C=C\C(N(C)C1=CC=CC=C1)=O