| SpectraBase Compound ID | FqNVqwo3Ozw |
|---|---|
| InChI | InChI=1S/C11H8F3N3OS/c1-6-4-2-3-5-7(6)8-16-17-10(19-8)15-9(18)11(12,13)14/h2-5H,1H3,(H,15,17,18) |
| InChIKey | RKHLRDHKWOGAGD-UHFFFAOYSA-N |
| Mol Weight | 287.26 g/mol |
| Molecular Formula | C11H8F3N3OS |
| Exact Mass | 287.034018 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HlaAsm4ILKN |
|---|---|
| Name | 1,3,4-Thiadiazole, 2-trifluoroacetamido-5-(2-methylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.034017552 u |
| Formula | C11H8F3N3OS |
| InChI | InChI=1S/C11H8F3N3OS/c1-6-4-2-3-5-7(6)8-16-17-10(19-8)15-9(18)11(12,13)14/h2-5H,1H3,(H,15,17,18) |
| InChIKey | RKHLRDHKWOGAGD-UHFFFAOYSA-N |
| Molecular Weight | 287.260 g/mol |
| SMILES | C1=CC=C(C(=C1)C)C=1SC(NC(C(F)(F)F)=O)=NN1 |