| SpectraBase Spectrum ID |
2OC3EEnOSwm |
| Name |
2'-Chloro-3,4-dimethoxythiocarbanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.054276603 u |
| Formula |
C15H15ClN2O2S |
| InChI |
InChI=1S/C15H15ClN2O2S/c1-19-13-8-7-10(9-14(13)20-2)17-15(21)18-12-6-4-3-5-11(12)16/h3-9H,1-2H3,(H2,17,18,21) |
| InChIKey |
AFUIDZVOPPKONT-UHFFFAOYSA-N |
| Molecular Weight |
322.810 g/mol |
| SMILES |
N(C1=C(C=CC=C1)Cl)C(NC=1C=CC(=C(C1)OC)OC)=S |
| Spectrum/Structure Validation Score (Raman) |
0.969364 |
