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

*Links on SpectraBase are not permalinks.

1-(m-Chlorophenyl)-3-(3,4-dimethoxyphenethyl)-2-thiourea

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

1-(m-Chlorophenyl)-3-(3,4-dimethoxyphenethyl)-2-thiourea
SpectraBase Compound ID 5nyP7k1cM6P
InChI InChI=1S/C17H19ClN2O2S/c1-21-15-7-6-12(10-16(15)22-2)8-9-19-17(23)20-14-5-3-4-13(18)11-14/h3-7,10-11H,8-9H2,1-2H3,(H2,19,20,23)
InChIKey FKXRINRAORKHCN-UHFFFAOYSA-N
Mol Weight 350.86 g/mol
Molecular Formula C17H19ClN2O2S
Exact Mass 350.085577 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 ElY2dJrq9rF
Name 1-(m-Chlorophenyl)-3-(3,4-dimethoxyphenethyl)-2-thiourea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.085576732 u
Formula C17H19ClN2O2S
InChI InChI=1S/C17H19ClN2O2S/c1-21-15-7-6-12(10-16(15)22-2)8-9-19-17(23)20-14-5-3-4-13(18)11-14/h3-7,10-11H,8-9H2,1-2H3,(H2,19,20,23)
InChIKey FKXRINRAORKHCN-UHFFFAOYSA-N
Molecular Weight 350.864 g/mol
SMILES N(CCC1=CC=C(C(=C1)OC)OC)C(NC=1C=CC=C(C1)Cl)=S
Spectrum/Structure Validation Score (Raman) 0.902924