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N'-(4-Chloro-2-methylphenyl)-N,N,N'-trimethylurea

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

N'-(4-Chloro-2-methylphenyl)-N,N,N'-trimethylurea
SpectraBase Compound ID JxM02OALszL
InChI InChI=1S/C11H15ClN2O/c1-8-7-9(12)5-6-10(8)14(4)11(15)13(2)3/h5-7H,1-4H3
InChIKey BHMXBNGCDDLZEG-UHFFFAOYSA-N
Mol Weight 226.71 g/mol
Molecular Formula C11H15ClN2O
Exact Mass 226.087291 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CHnsM3dKWzg
Name N'-(4-Chloro-2-methylphenyl)-N,N,N'-trimethylurea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.087290810 u
Formula C11H15ClN2O
InChI InChI=1S/C11H15ClN2O/c1-8-7-9(12)5-6-10(8)14(4)11(15)13(2)3/h5-7H,1-4H3
InChIKey BHMXBNGCDDLZEG-UHFFFAOYSA-N
Molecular Weight 226.707 g/mol
SMILES C=1(N(C)C(=O)N(C)C)C=CC(=CC1C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.891701