| SpectraBase Compound ID | Jqw90Np5Lk8 |
|---|---|
| InChI | InChI=1S/C10H8F3N3/c11-10(12,13)7-3-1-2-6(4-7)8-5-9(14)16-15-8/h1-5H,(H3,14,15,16) |
| InChIKey | UKCQZEKREUKMTN-UHFFFAOYSA-N |
| Mol Weight | 227.19 g/mol |
| Molecular Formula | C10H8F3N3 |
| Exact Mass | 227.067032 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AC0CIDTQl3M |
|---|---|
| Name | Pyrazole-5-amine, 3-(3-trifluoromethylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.067031759 u |
| Formula | C10H8F3N3 |
| InChI | InChI=1S/C10H8F3N3/c11-10(12,13)7-3-1-2-6(4-7)8-5-9(14)16-15-8/h1-5H,(H3,14,15,16) |
| InChIKey | UKCQZEKREUKMTN-UHFFFAOYSA-N |
| Molecular Weight | 227.190 g/mol |
| SMILES | C=1C(=NNC1N)C=1C=CC=C(C(F)(F)F)C1 |