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3-Chloro-2',4,6'-trimethylcarbanilide

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

3-Chloro-2',4,6'-trimethylcarbanilide
SpectraBase Compound ID LIerXNpNpYa
InChI InChI=1S/C16H17ClN2O/c1-10-7-8-13(9-14(10)17)18-16(20)19-15-11(2)5-4-6-12(15)3/h4-9H,1-3H3,(H2,18,19,20)
InChIKey ITOLOWZLQQEEKU-UHFFFAOYSA-N
Mol Weight 288.78 g/mol
Molecular Formula C16H17ClN2O
Exact Mass 288.102941 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4dfT2cvNJTp
Name 3-Chloro-2',4,6'-trimethylcarbanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.102940874 u
Formula C16H17ClN2O
InChI InChI=1S/C16H17ClN2O/c1-10-7-8-13(9-14(10)17)18-16(20)19-15-11(2)5-4-6-12(15)3/h4-9H,1-3H3,(H2,18,19,20)
InChIKey ITOLOWZLQQEEKU-UHFFFAOYSA-N
Molecular Weight 288.778 g/mol
SMILES N(C1=C(C=CC=C1C)C)C(NC=1C=CC(=C(C1)Cl)C)=O
Spectrum/Structure Validation Score (Raman) 0.867861