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(2E)-3-(4-methoxyphenyl)-N-[3-({[(2E)-3-(4-methoxyphenyl)-2-propenoyl]amino}methyl)benzyl]-2-propenamide
SpectraBase Compound ID IfZYaRQgYTR
InChI InChI=1S/C28H28N2O4/c1-33-25-12-6-21(7-13-25)10-16-27(31)29-19-23-4-3-5-24(18-23)20-30-28(32)17-11-22-8-14-26(34-2)15-9-22/h3-18H,19-20H2,1-2H3,(H,29,31)(H,30,32)/b16-10+,17-11+
InChIKey MKHNOZLTGLMQLE-OTYYAQKOSA-N
Mol Weight 456.54 g/mol
Molecular Formula C28H28N2O4
Exact Mass 456.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9a6iHeXmWcU
Name (2E)-3-(4-Methoxyphenyl)-N-[3-({[(2E)-3-(4-methoxyphenyl)-2-propenoyl]amino}methyl)benzyl]-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 456.204907386 u
Formula C28H28N2O4
InChI InChI=1S/C28H28N2O4/c1-33-25-12-6-21(7-13-25)10-16-27(31)29-19-23-4-3-5-24(18-23)20-30-28(32)17-11-22-8-14-26(34-2)15-9-22/h3-18H,19-20H2,1-2H3,(H,29,31)(H,30,32)/b16-10+,17-11+
InChIKey MKHNOZLTGLMQLE-OTYYAQKOSA-N
Molecular Weight 456.542 g/mol
SMILES N(C(\C=C\C=1C=CC(=CC1)OC)=O)CC=1C=C(CNC(\C=C\C2=CC=C(C=C2)OC)=O)C=CC1