| SpectraBase Compound ID | 6nmeF65w4pl |
|---|---|
| InChI | InChI=1S/C12H12F3N3S/c1-6-4-7(2)9(8(3)5-6)16-11-18-17-10(19-11)12(13,14)15/h4-5H,1-3H3,(H,16,18) |
| InChIKey | KKYVDMDCXKIJFT-UHFFFAOYSA-N |
| Mol Weight | 287.3 g/mol |
| Molecular Formula | C12H12F3N3S |
| Exact Mass | 287.070403 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ns9X49ton5 |
|---|---|
| Name | 1,3,4-Thiadiazole, 2-trifluoromethyl-5-(2,4,6-trimethylphenylamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.070403061 u |
| Formula | C12H12F3N3S |
| InChI | InChI=1S/C12H12F3N3S/c1-6-4-7(2)9(8(3)5-6)16-11-18-17-10(19-11)12(13,14)15/h4-5H,1-3H3,(H,16,18) |
| InChIKey | KKYVDMDCXKIJFT-UHFFFAOYSA-N |
| Molecular Weight | 287.304 g/mol |
| SMILES | C=1(SC(NC=2C(C)=CC(C)=CC2C)=NN1)C(F)(F)F |