| SpectraBase Compound ID | HJ8wuspF3Sn |
|---|---|
| InChI | InChI=1S/C14H9ClN2OS/c15-12-9-5-1-2-6-10(9)19-13(12)14(18)17-11-7-3-4-8-16-11/h1-8H,(H,16,17,18) |
| InChIKey | TXAGZDSNYBPKQI-UHFFFAOYSA-N |
| Mol Weight | 288.75 g/mol |
| Molecular Formula | C14H9ClN2OS |
| Exact Mass | 288.012412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 67PS1DcdDtw |
|---|---|
| Name | 3-Chloranyl-N-pyridin-2-yl-1-benzothiophene-2-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.012411791 u |
| Formula | C14H9ClN2OS |
| InChI | InChI=1S/C14H9ClN2OS/c15-12-9-5-1-2-6-10(9)19-13(12)14(18)17-11-7-3-4-8-16-11/h1-8H,(H,16,17,18) |
| InChIKey | TXAGZDSNYBPKQI-UHFFFAOYSA-N |
| SMILES | C=1(SC2=CC=CC=C2C1Cl)C(NC1=NC=CC=C1)=O |