| SpectraBase Compound ID | CdWC5ZCAm3w |
|---|---|
| InChI | InChI=1S/C13H13N3S/c14-11-8-4-5-9-12(11)16-13(17)15-10-6-2-1-3-7-10/h1-9H,14H2,(H2,15,16,17) |
| InChIKey | GZMPOVCWIYERNT-UHFFFAOYSA-N |
| Mol Weight | 243.33 g/mol |
| Molecular Formula | C13H13N3S |
| Exact Mass | 243.083019 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 22FJwgPc0zN |
|---|---|
| Name | 2-Aminothiocarbanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.083018605 u |
| Formula | C13H13N3S |
| InChI | InChI=1S/C13H13N3S/c14-11-8-4-5-9-12(11)16-13(17)15-10-6-2-1-3-7-10/h1-9H,14H2,(H2,15,16,17) |
| InChIKey | GZMPOVCWIYERNT-UHFFFAOYSA-N |
| Molecular Weight | 243.328 g/mol |
| SMILES | N(C1=CC=CC=C1)C(=S)NC1=C(C=CC=C1)N |
| Spectrum/Structure Validation Score (Raman) | 0.793015 |