![2,2,2-Trifluoro-N-(5-phenyl-[1,3,4]thiadiazol-2-yl)-acetamide](/api/spectrum/17b0kxuoDe4/structure.png?h=300&w=458 "2,2,2-Trifluoro-N-(5-phenyl-[1,3,4]thiadiazol-2-yl)-acetamide")
| SpectraBase Compound ID | IgxPngF9BTo |
|---|---|
| InChI | InChI=1S/C10H6F3N3OS/c11-10(12,13)8(17)14-9-16-15-7(18-9)6-4-2-1-3-5-6/h1-5H,(H,14,16,17) |
| InChIKey | HVJQDWUYSVRXKC-UHFFFAOYSA-N |
| Mol Weight | 273.23 g/mol |
| Molecular Formula | C10H6F3N3OS |
| Exact Mass | 273.018367 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 17b0kxuoDe4 |
|---|---|
| Name | 2,2,2-Trifluoro-N-(5-phenyl-[1,3,4]thiadiazol-2-yl)-acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.018367487 u |
| Formula | C10H6F3N3OS |
| InChI | InChI=1S/C10H6F3N3OS/c11-10(12,13)8(17)14-9-16-15-7(18-9)6-4-2-1-3-5-6/h1-5H,(H,14,16,17) |
| InChIKey | HVJQDWUYSVRXKC-UHFFFAOYSA-N |
| Molecular Weight | 273.233 g/mol |
| SMILES | C1=CC=C(C=C1)C=1SC(NC(C(F)(F)F)=O)=NN1 |