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2-Propenoic acid, 2-(acetylamino)-3-phenyl-, ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-Propenoic acid, 2-(acetylamino)-3-phenyl-, ethyl ester
SpectraBase Compound ID GnIhTWsxdjz
InChI InChI=1S/C13H15NO3/c1-3-17-13(16)12(14-10(2)15)9-11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,14,15)/b12-9-
InChIKey PMVKSDPWGBZTFB-XFXZXTDPSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6senLy2Pk0b
Name 2-Propenoic acid, 2-(acetylamino)-3-phenyl-, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.105193344 u
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-3-17-13(16)12(14-10(2)15)9-11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,14,15)/b12-9-
InChIKey PMVKSDPWGBZTFB-XFXZXTDPSA-N
Molecular Weight 233.267 g/mol
SMILES C(\C(NC(=O)C)=C\C1=CC=CC=C1)(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932164