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2,6-Diethylcarbanilic acid, butyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2,6-Diethylcarbanilic acid, butyl ester
SpectraBase Compound ID wEwjdP4BCS
InChI InChI=1S/C15H23NO2/c1-4-7-11-18-15(17)16-14-12(5-2)9-8-10-13(14)6-3/h8-10H,4-7,11H2,1-3H3,(H,16,17)
InChIKey DKOLMXOAZZFDOK-UHFFFAOYSA-N
Mol Weight 249.35 g/mol
Molecular Formula C15H23NO2
Exact Mass 249.172879 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID K5VFnVBHSz7
Name 2,6-Diethylcarbanilic acid, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.172878983 u
Formula C15H23NO2
InChI InChI=1S/C15H23NO2/c1-4-7-11-18-15(17)16-14-12(5-2)9-8-10-13(14)6-3/h8-10H,4-7,11H2,1-3H3,(H,16,17)
InChIKey DKOLMXOAZZFDOK-UHFFFAOYSA-N
Molecular Weight 249.354 g/mol
SMILES N(C1=C(C=CC=C1CC)CC)C(OCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.950217