For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-[(2Z)-2-(benzoylamino)-3-phenyl-2-propenoyl]-3-phenyl-beta-alanine

View entire compound with spectra: 2 NMR

N-[(2Z)-2-(benzoylamino)-3-phenyl-2-propenoyl]-3-phenyl-beta-alanine
SpectraBase Compound ID 75KihrAAEbd
InChI InChI=1S/C25H22N2O4/c28-23(29)17-21(19-12-6-2-7-13-19)26-25(31)22(16-18-10-4-1-5-11-18)27-24(30)20-14-8-3-9-15-20/h1-16,21H,17H2,(H,26,31)(H,27,30)(H,28,29)/b22-16-
InChIKey HURYDRANBZDEAQ-JWGURIENSA-N
Mol Weight 414.46 g/mol
Molecular Formula C25H22N2O4
Exact Mass 414.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GOO5d3HC6TR
Name N-[(2Z)-2-(Benzoylamino)-3-phenyl-2-propenoyl]-3-phenyl-beta-alanine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.157957192 u
Formula C25H22N2O4
InChI InChI=1S/C25H22N2O4/c28-23(29)17-21(19-12-6-2-7-13-19)26-25(31)22(16-18-10-4-1-5-11-18)27-24(30)20-14-8-3-9-15-20/h1-16,21H,17H2,(H,26,31)(H,27,30)(H,28,29)/b22-16-
InChIKey HURYDRANBZDEAQ-JWGURIENSA-N
Molecular Weight 414.461 g/mol
SMILES N(C(\C(NC(=O)C1=CC=CC=C1)=C/C1=CC=CC=C1)=O)C(CC(=O)O)C=1C=CC=CC1