| SpectraBase Compound ID | DUAmZGJr6lf |
|---|---|
| InChI | InChI=1S/C13H12N2S/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12/h2-9H,1H3,(H,15,16) |
| InChIKey | HWHBUFUUNCGXAY-UHFFFAOYSA-N |
| Mol Weight | 228.31 g/mol |
| Molecular Formula | C13H12N2S |
| Exact Mass | 228.07212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3AG6RL0yWz9 |
|---|---|
| Name | N-(4-Methylphenyl)-2-pyridinecarbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.072119568 u |
| Formula | C13H12N2S |
| InChI | InChI=1S/C13H12N2S/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12/h2-9H,1H3,(H,15,16) |
| InChIKey | HWHBUFUUNCGXAY-UHFFFAOYSA-N |
| Molecular Weight | 228.313 g/mol |
| SMILES | C(NC1=CC=C(C=C1)C)(=S)C1=NC=CC=C1 |