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2,6-Diethylcarbanilic acid, propyl ester

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

2,6-Diethylcarbanilic acid, propyl ester
SpectraBase Compound ID JLsvFFDnR5c
InChI InChI=1S/C14H21NO2/c1-4-10-17-14(16)15-13-11(5-2)8-7-9-12(13)6-3/h7-9H,4-6,10H2,1-3H3,(H,15,16)
InChIKey JKQTWWQFRQCDPI-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 5yT25zl1Mwt
Name 2,6-Diethylcarbanilic acid, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-4-10-17-14(16)15-13-11(5-2)8-7-9-12(13)6-3/h7-9H,4-6,10H2,1-3H3,(H,15,16)
InChIKey JKQTWWQFRQCDPI-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES N(C1=C(C=CC=C1CC)CC)C(OCCC)=O
Spectrum/Structure Validation Score (Raman) 0.896846