| SpectraBase Compound ID | tdIsAO5DHp |
|---|---|
| InChI | InChI=1S/C5H4F3N3O/c1-11-4(9-2-10-11)3(12)5(6,7)8/h2H,1H3 |
| InChIKey | LHOKPTAHIWFGDY-UHFFFAOYSA-N |
| Mol Weight | 179.1 g/mol |
| Molecular Formula | C5H4F3N3O |
| Exact Mass | 179.030646 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BJmo67zIKWE |
|---|---|
| Name | 2,2,2-Trifluoro-1-(1-methyl-1H-1,2,4-triazol-5-yl)ethanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H4F3N3O |
| InChI | InChI=1S/C5H4F3N3O/c1-11-4(9-2-10-11)3(12)5(6,7)8/h2H,1H3 |
| InChIKey | LHOKPTAHIWFGDY-UHFFFAOYSA-N |
| Molecular Weight | 179.102 g/mol |
| SMILES | c1(C(C(F)(F)F)=O)ncn[n]1C |
| SPLASH | splash10-03e9-9800000000-bc10ee088947d5ec4f2c |
| Source of Spectrum | F4-40-951-4g |
| Wiley ID | 1670398 |