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Ethyl (E)-2-benzamido-4-(3,4-dimethoxyphenyl)but-3-enoate

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Ethyl (E)-2-benzamido-4-(3,4-dimethoxyphenyl)but-3-enoate
SpectraBase Compound ID HkKvkyhVQQM
InChI InChI=1S/C21H23NO5/c1-4-27-21(24)17(22-20(23)16-8-6-5-7-9-16)12-10-15-11-13-18(25-2)19(14-15)26-3/h5-14,17H,4H2,1-3H3,(H,22,23)/b12-10+
InChIKey MBWLSHMOWPKKRN-ZRDIBKRKSA-N
Mol Weight 369.42 g/mol
Molecular Formula C21H23NO5
Exact Mass 369.157623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40aJmzmybP8
Name Ethyl (E)-2-benzamido-4-(3,4-dimethoxyphenyl)but-3-enoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.157622840 u
Formula C21H23NO5
InChI InChI=1S/C21H23NO5/c1-4-27-21(24)17(22-20(23)16-8-6-5-7-9-16)12-10-15-11-13-18(25-2)19(14-15)26-3/h5-14,17H,4H2,1-3H3,(H,22,23)/b12-10+
InChIKey MBWLSHMOWPKKRN-ZRDIBKRKSA-N
Molecular Weight 369.417 g/mol
SMILES C(NC(C(=O)OCC)\C=C\C=1C=C(OC)C(=CC1)OC)(=O)C=1C=CC=CC1