| SpectraBase Compound ID | 91nDti4pKU7 |
|---|---|
| InChI | InChI=1S/C13H10ClNS/c14-11-6-8-12(9-7-11)15-13(16)10-4-2-1-3-5-10/h1-9H,(H,15,16) |
| InChIKey | QTQYTNZDYLXLPM-UHFFFAOYSA-N |
| Mol Weight | 247.74 g/mol |
| Molecular Formula | C13H10ClNS |
| Exact Mass | 247.022248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ir353TMPh8V |
|---|---|
| Name | N-(4-Chlorophenyl)benzenecarbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.022248200 u |
| Formula | C13H10ClNS |
| InChI | InChI=1S/C13H10ClNS/c14-11-6-8-12(9-7-11)15-13(16)10-4-2-1-3-5-10/h1-9H,(H,15,16) |
| InChIKey | QTQYTNZDYLXLPM-UHFFFAOYSA-N |
| Molecular Weight | 247.743 g/mol |
| SMILES | C(=S)(NC1=CC=C(C=C1)Cl)C1=CC=CC=C1 |