| SpectraBase Spectrum ID |
KCFPTFQvrwf |
| Name |
Trithiocarbonic acid, bis(p-chlorophenyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.916519180 u |
| Formula |
C13H8Cl2S3 |
| InChI |
InChI=1S/C13H8Cl2S3/c14-9-1-5-11(6-2-9)17-13(16)18-12-7-3-10(15)4-8-12/h1-8H |
| InChIKey |
GUUHSHAWOOMFMF-UHFFFAOYSA-N |
| Molecular Weight |
331.293 g/mol |
| SMILES |
C1=C(C=CC(=C1)Cl)SC(SC=1C=CC(=CC1)Cl)=S |
| Spectrum/Structure Validation Score (Raman) |
0.891412 |
