![N,N-Dimethyl-4-[(trichloromethyl)thio]-m-toluidine](/api/spectrum/EOgkl6nLy4B/structure.png?h=300&w=458 "N,N-Dimethyl-4-[(trichloromethyl)thio]-m-toluidine")
| SpectraBase Compound ID | FugLzK5Gqhx |
|---|---|
| InChI | InChI=1S/C10H12Cl3NS/c1-7-6-8(14(2)3)4-5-9(7)15-10(11,12)13/h4-6H,1-3H3 |
| InChIKey | MMJQGZNLNZYVAR-UHFFFAOYSA-N |
| Mol Weight | 284.63 g/mol |
| Molecular Formula | C10H12Cl3NS |
| Exact Mass | 282.975604 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EOgkl6nLy4B |
|---|---|
| Name | N,N-Dimethyl-4-[(trichloromethyl)thio]-m-toluidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.975603664 u |
| Formula | C10H12Cl3NS |
| InChI | InChI=1S/C10H12Cl3NS/c1-7-6-8(14(2)3)4-5-9(7)15-10(11,12)13/h4-6H,1-3H3 |
| InChIKey | MMJQGZNLNZYVAR-UHFFFAOYSA-N |
| SMILES | C=1(C)C=C(C=CC1SC(Cl)(Cl)Cl)N(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.8366 |