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2,6-Diethylcarbanilic acid, ethyl ester

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

2,6-Diethylcarbanilic acid, ethyl ester
SpectraBase Compound ID FqK4US12nMg
InChI InChI=1S/C13H19NO2/c1-4-10-8-7-9-11(5-2)12(10)14-13(15)16-6-3/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKey LZIGLLZNFIPKDI-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LHjieoHvCFG
Name 2,6-Diethylcarbanilic acid, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.141578854 u
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-4-10-8-7-9-11(5-2)12(10)14-13(15)16-6-3/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKey LZIGLLZNFIPKDI-UHFFFAOYSA-N
Molecular Weight 221.300 g/mol
SMILES N(C1=C(C=CC=C1CC)CC)C(OCC)=O
Spectrum/Structure Validation Score (Raman) 0.88455