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(E)-N-methyl-3-oxo-5-phenyl-4-pentenamide

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

(E)-N-methyl-3-oxo-5-phenyl-4-pentenamide
SpectraBase Compound ID 1lOOGeAqe6h
InChI InChI=1S/C12H13NO2/c1-13-12(15)9-11(14)8-7-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,13,15)/b8-7+
InChIKey LCRUGCDLDCLNQW-BQYQJAHWSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ByujJTuhix7
Name (E)-N-Methyl-3-oxo-5-phenyl-4-pentenamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.094628661 u
Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c1-13-12(15)9-11(14)8-7-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,13,15)/b8-7+
InChIKey LCRUGCDLDCLNQW-BQYQJAHWSA-N
Molecular Weight 203.241 g/mol
SMILES C(C(=O)NC)C(\C=C\C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955246