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5-Chloro-2',6'-diethyl-2-methylcarbanilide

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

5-Chloro-2',6'-diethyl-2-methylcarbanilide
SpectraBase Compound ID BEhhEFGf0MJ
InChI InChI=1S/C18H21ClN2O/c1-4-13-7-6-8-14(5-2)17(13)21-18(22)20-16-11-15(19)10-9-12(16)3/h6-11H,4-5H2,1-3H3,(H2,20,21,22)
InChIKey JVCBGCNTWMWELY-UHFFFAOYSA-N
Mol Weight 316.83 g/mol
Molecular Formula C18H21ClN2O
Exact Mass 316.134241 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Hu9bBrfsKwi
Name 5-Chloro-2',6'-diethyl-2-methylcarbanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.134241003 u
Formula C18H21ClN2O
InChI InChI=1S/C18H21ClN2O/c1-4-13-7-6-8-14(5-2)17(13)21-18(22)20-16-11-15(19)10-9-12(16)3/h6-11H,4-5H2,1-3H3,(H2,20,21,22)
InChIKey JVCBGCNTWMWELY-UHFFFAOYSA-N
SMILES N(C1=C(C=CC=C1CC)CC)C(NC1=C(C=CC(=C1)Cl)C)=O
Spectrum/Structure Validation Score (Raman) 0.901157