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2-Benzamido-4-phenyl-butyric acid ethyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

2-Benzamido-4-phenyl-butyric acid ethyl ester
SpectraBase Compound ID EZjK3uIIKBJ
InChI InChI=1S/C19H21NO3/c1-2-23-19(22)17(14-13-15-9-5-3-6-10-15)20-18(21)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,20,21)
InChIKey BBGVYTQLRUAOLT-UHFFFAOYSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID JRhjjIWKnL4
Name 2-Benzamido-4-phenylbutyric acid, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.152143537 u
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-2-23-19(22)17(14-13-15-9-5-3-6-10-15)20-18(21)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,20,21)
InChIKey BBGVYTQLRUAOLT-UHFFFAOYSA-N
SMILES N(C(CCC1=CC=CC=C1)C(OCC)=O)C(C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Raman) 0.961987