For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-(3-Chloro-p-tolyl)-1,1-diethylurea

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

3-(3-Chloro-p-tolyl)-1,1-diethylurea
SpectraBase Compound ID DSZtYlCEv9Q
InChI InChI=1S/C12H17ClN2O/c1-4-15(5-2)12(16)14-10-7-6-9(3)11(13)8-10/h6-8H,4-5H2,1-3H3,(H,14,16)
InChIKey NTXSMLYMIGVDRF-UHFFFAOYSA-N
Mol Weight 240.73 g/mol
Molecular Formula C12H17ClN2O
Exact Mass 240.102941 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DxiMjHexj7u
Name 3-(3-Chloro-p-tolyl)-1,1-diethylurea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.102940874 u
Formula C12H17ClN2O
InChI InChI=1S/C12H17ClN2O/c1-4-15(5-2)12(16)14-10-7-6-9(3)11(13)8-10/h6-8H,4-5H2,1-3H3,(H,14,16)
InChIKey NTXSMLYMIGVDRF-UHFFFAOYSA-N
Molecular Weight 240.734 g/mol
SMILES N(C1=CC=C(C(=C1)Cl)C)C(N(CC)CC)=O
Spectrum/Structure Validation Score (Raman) 0.725233