![1,2,4-Triazolo[3,4-a]phthalazine, 3-pentafluoroethyl-6-(3,5-dimethyl-1-pyrazolyl)-](/api/spectrum/AbWFGk4tcOa/structure.png?h=300&w=458 "1,2,4-Triazolo[3,4-a]phthalazine, 3-pentafluoroethyl-6-(3,5-dimethyl-1-pyrazolyl)-")
| SpectraBase Compound ID | 98gK9QbDNDN |
|---|---|
| InChI | InChI=1S/C16H11F5N6/c1-8-7-9(2)26(24-8)13-11-6-4-3-5-10(11)12-22-23-14(27(12)25-13)15(17,18)16(19,20)21/h3-7H,1-2H3 |
| InChIKey | HGBXUINVFNLIJG-UHFFFAOYSA-N |
| Mol Weight | 382.3 g/mol |
| Molecular Formula | C16H11F5N6 |
| Exact Mass | 382.096535 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AbWFGk4tcOa |
|---|---|
| Name | 1,2,4-Triazolo[3,4-a]phthalazine, 3-pentafluoroethyl-6-(3,5-dimethyl-1-pyrazolyl)- |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11F5N6 |
| InChI | InChI=1S/C16H11F5N6/c1-8-7-9(2)26(24-8)13-11-6-4-3-5-10(11)12-22-23-14(27(12)25-13)15(17,18)16(19,20)21/h3-7H,1-2H3 |
| InChIKey | HGBXUINVFNLIJG-UHFFFAOYSA-N |
| Molecular Weight | 382.298 g/mol |
| SMILES | c1cc2-c3[n](c(C(C(F)(F)F)(F)F)nn3)N=C([n]3nc(C)cc3C)c2cc1 |
| SPLASH | splash10-001u-9404000000-5584c71f3721f1e6843d |
| Synonyms | 6-(3,5-dimethyl-1-pyrazolyl)-3-(1,1,2,2,2-pentafluoroethyl)-[1,2,4]triazolo[3,4-a]phthalazine 6-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazine 6-(3,5-dimethylpyrazol-1-yl)-3-(1,1,2,2,2-pentafluoroethyl)-[1,2,4]triazolo[3,4-a]phthalazine 6-(3,5-dimethylpyrazol-1-yl)-3-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-[1,2,4]triazolo[3,4-a]phthalazine |
| Wiley ID | 1455581 |