![2-[3-Methyl-5-(trifluoromethyl)-1-pyrazolyl]-4-phenylthiazole](/api/spectrum/5oFDfmlpONz/structure.png?h=300&w=458 "2-[3-Methyl-5-(trifluoromethyl)-1-pyrazolyl]-4-phenylthiazole")
| SpectraBase Compound ID | Gpfq1hdUYSM |
|---|---|
| InChI | InChI=1S/C14H10F3N3S/c1-9-7-12(14(15,16)17)20(19-9)13-18-11(8-21-13)10-5-3-2-4-6-10/h2-8H,1H3 |
| InChIKey | RZUKZGUNCDXTDL-UHFFFAOYSA-N |
| Mol Weight | 309.31 g/mol |
| Molecular Formula | C14H10F3N3S |
| Exact Mass | 309.054753 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5oFDfmlpONz |
|---|---|
| Name | 2-[3-Methyl-5-(trifluoromethyl)-1-pyrazolyl]-4-phenylthiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.054752997 u |
| Formula | C14H10F3N3S |
| InChI | InChI=1S/C14H10F3N3S/c1-9-7-12(14(15,16)17)20(19-9)13-18-11(8-21-13)10-5-3-2-4-6-10/h2-8H,1H3 |
| InChIKey | RZUKZGUNCDXTDL-UHFFFAOYSA-N |
| Molecular Weight | 309.310 g/mol |
| SMILES | C=1(N(N=C(C1)C)C1=NC(C=2C=CC=CC2)=CS1)C(F)(F)F |