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3-(m-Chlorophenyl)-1,1-diethylurea

View entire compound with spectra: 3 NMR, 1 FTIR, 1 Raman, and 2 MS (GC)

3-(m-Chlorophenyl)-1,1-diethylurea
SpectraBase Compound ID HBsY6nzh5jb
InChI InChI=1S/C11H15ClN2O/c1-3-14(4-2)11(15)13-10-7-5-6-9(12)8-10/h5-8H,3-4H2,1-2H3,(H,13,15)
InChIKey FXODCODKNPOVAX-UHFFFAOYSA-N
Mol Weight 226.71 g/mol
Molecular Formula C11H15ClN2O
Exact Mass 226.087291 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 6qBSW2b5MvY
Name 3-(m-Chlorophenyl)-1,1-diethylurea
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/c1-3-14(4-2)11(15)13-10-7-5-6-9(12)8-10/h5-8H,3-4H2,1-2H3,(H,13,15)
InChIKey FXODCODKNPOVAX-UHFFFAOYSA-N
Molecular Weight 226.707 g/mol
SMILES N(C1=CC=CC(=C1)Cl)C(=O)N(CC)CC
Spectrum/Structure Validation Score (Raman) 0.95518