SpectraBase Spectrum ID |
CxQDedzYBfC |
Name |
1-(2-Hydroxyethyl)-3-(p-methoxyphenyl)-2-thiourea |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
226.077598871 u |
Formula |
C10H14N2O2S |
InChI |
InChI=1S/C10H14N2O2S/c1-14-9-4-2-8(3-5-9)12-10(15)11-6-7-13/h2-5,13H,6-7H2,1H3,(H2,11,12,15) |
InChIKey |
KGDNJJRUJMQSLZ-UHFFFAOYSA-N |
Molecular Weight |
226.294 g/mol |
SMILES |
N(C1=CC=C(C=C1)OC)C(NCCO)=S |
Spectrum/Structure Validation Score (Raman) |
0.831782 |