![Benzenamine, 4-[(4-chlorophenyl)thio]-](/api/spectrum/5fVKEWqVJTE/structure.png?h=300&w=458 "Benzenamine, 4-[(4-chlorophenyl)thio]-")
| SpectraBase Compound ID | Kg1wBXYMZRT |
|---|---|
| InChI | InChI=1S/C12H10ClNS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2 |
| InChIKey | DVTZWUZZYSGZLE-UHFFFAOYSA-N |
| Mol Weight | 235.73 g/mol |
| Molecular Formula | C12H10ClNS |
| Exact Mass | 235.022248 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5fVKEWqVJTE |
|---|---|
| Name | Benzenamine, 4-[(4-chlorophenyl)thio]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.022248200 u |
| Formula | C12H10ClNS |
| InChI | InChI=1S/C12H10ClNS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2 |
| InChIKey | DVTZWUZZYSGZLE-UHFFFAOYSA-N |
| Molecular Weight | 235.732 g/mol |
| SMILES | NC1=CC=C(SC2=CC=C(C=C2)Cl)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.95716 |